Carbamothioic acid, [(1-methoxy-1H-indol-3-yl)methyl]-, S-methyl ester

CAS Registry Number®

113900-63-3

CAS Name

Carbamothioic acid, [(1-methoxy-1H-indol-3-yl)methyl]-, S-methyl ester

Molecular Formula

C12H14N2O2S

Molecular Mass

250.32

Cite this Page

Carbamothioic acid, [(1-methoxy-1H-indol-3-yl)methyl]-, S-methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=113900-63-3 (retrieved 2025-01-07) (CAS RN: 113900-63-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    94-96 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C12H14N2O2S/c1-16-14-8-9(7-13-12(15)17-2)10-5-3-4-6-11(10)14/h3-6,8H,7H2,1-2H3,(H,13,15)

InChIKey

InChIKey=BHXCFNZULGNWRA-UHFFFAOYSA-N

SMILES

C(NC(SC)=O)C=1C=2C(N(OC)C1)=CC=CC2

Canonical SMILES

O=C(SC)NCC1=CN(OC)C=2C=CC=CC21

Other Names for this Substance

  • Carbamothioic acid, [(1-methoxy-1H-indol-3-yl)methyl]-, S-methyl ester
  • 1-Methoxybrassitin

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