CAS Registry Number®

1246820-35-8
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Molecular Formula

C20H18D6N2O3S

Cite this Page

.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1246820-35-8 (retrieved 2024-08-28) (CAS RN: 1246820-35-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C20H24N2O3S/c1-21(2)12-13-22-16-6-4-5-7-17(16)26-19(18(23)20(22)24)14-8-10-15(25-3)11-9-14/h4-11,18-19,23H,12-13H2,1-3H3/t18-,19+/s2/i1D3,2D3

InChIKey

InChIKey=NZHUXMZTSSZXSB-WEAKZVRXNA-N

SMILES

C(CN(C([2H])([2H])[2H])C([2H])([2H])[2H])N1C=2C(S[C@H]([C@@H](O)C1=O)C3=CC=C(OC)C=C3)=CC=CC2

Canonical SMILES

O=C1N(C=2C=CC=CC2SC(C3=CC=C(OC)C=C3)C1O)CCN(C)C