Vitas-M small molecule compound
(2E)-3-(4-chlorophenyl)-N-(2-oxotetrahydrothiophen-3-yl)prop-2-enamide
Catalog ID
STK000597
SMILES O=C(NC1CCSC1=O)/C=C/c1ccc(cc1)Cl
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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 C13H12ClNO2S MW 281.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12ClNO2S/c14-10-4-1-9(2-5-10)3-6-12(16)15-11-7-8-18-13(11)17/h1-6,11H,7-8H2,(H,15,16)/b6-3+InChIKey
LBHGBGCWVISPQM-ZZXKWVIFSA-NSynonyms
956987-45-4(2E)3(4CHLOROPHENYL)N(2OXOTETRAHYDROTHIOPHEN3YL)PROP2ENAMIDE
(E)3(4CHLOROPHENYL)N(2OXOTHIOLAN3YL)PROP2ENAMIDE
956987454
C1CSC(=O)C1NC(=O)C=CC2=CC=C(C=C2)Cl
InChI=1SC13H12ClNO2Sc1410419(2510)3612(16)1511781813(11)17h1611H78H2(H1516)b63+
MFCD03638306
O=C(NC1CCSC1=O)C=Cc1ccc(cc1)Cl
STK000597
ZINC000000465117
ZINC000000465119
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