Vitas-M small molecule compound

N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-6,8-dimethyl-4-oxo-4H-chromene-2-carboxamide

Catalog ID
STK520574
SMILES Cc1cc(C)c2c(c1)c(=O)cc(o2)C(=O)Nc1nnc(s1)SCc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C21H17N3O3S2 MW 423.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O3S2/c1-12-8-13(2)18-15(9-12)16(25)10-17(27-18)19(26)22-20-23-24-21(29-20)28-11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,22,23,26)
InChIKey
QMCHHAOLVUFBLF-UHFFFAOYSA-N
Synonyms

CC1=CC(=C2C(=C1)C(=O)C=C(O2)C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4)C
InChI=1SC21H17N3O3S2c112813(2)1815(912)16(25)1017(2718)19(26)2220232421(2920)2811146435714h310H11H212H3(H222326)
MFCD06603065
N(5(benzylsulfanyl)134thiadiazol2yl)68dimethyl4oxo4Hchromene2carboxamide
N(5BENZYLSULFANYL134THIADIAZOL2YL)68DIMETHYL4OXOCHROMENE2CARBOXAMIDE
ZINC000002237174
ZINC02237174
ZINC2237174

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Available files

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