Fantofarone

CAS Registry Number®

114432-13-2

CAS Name

Fantofarone

Molecular Formula

C31H38N2O5S

Molecular Mass

550.71

Cite this Page

Fantofarone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=114432-13-2 (retrieved 2024-11-22) (CAS RN: 114432-13-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    82-83 °C

  • Density (1)

    1.21 g/cm³

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C31H38N2O5S/c1-23(2)27-22-33-18-7-6-9-28(33)31(27)39(34,35)26-13-11-25(12-14-26)38-20-8-17-32(3)19-16-24-10-15-29(36-4)30(21-24)37-5/h6-7,9-15,18,21-23H,8,16-17,19-20H2,1-5H3

InChIKey

InChIKey=ITAMRBIZWGDOHW-UHFFFAOYSA-N

SMILES

S(=O)(=O)(C1=C2N(C=C1C(C)C)C=CC=C2)C3=CC=C(OCCCN(CCC4=CC(OC)=C(OC)C=C4)C)C=C3

Canonical SMILES

O=S(=O)(C1=CC=C(OCCCN(C)CCC2=CC=C(OC)C(OC)=C2)C=C1)C3=C4C=CC=CN4C=C3C(C)C

Other Names for this Substance

  • Benzeneethanamine, 3,4-dimethoxy-N-methyl-N-[3-[4-[[2-(1-methylethyl)-1-indolizinyl]sulfonyl]phenoxy]propyl]-
  • 3,4-Dimethoxy-N-methyl-N-[3-[4-[[2-(1-methylethyl)-1-indolizinyl]sulfonyl]phenoxy]propyl]benzeneethanamine
  • SR 33557
  • Fantofarone

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