Vitas-M small molecule compound
methyl 2-{[(2E)-3-(3-chlorophenyl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK440262
SMILES COC(=O)c1c(NC(=O)/C=C/c2cccc(c2)Cl)sc2c1CCCC2
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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 C19H18ClNO3S MW 375.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClNO3S/c1-24-19(23)17-14-7-2-3-8-15(14)25-18(17)21-16(22)10-9-12-5-4-6-13(20)11-12/h4-6,9-11H,2-3,7-8H2,1H3,(H,21,22)/b10-9+InChIKey
GPSSYQJKFFWMOU-MDZDMXLPSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C=CC3=CC(=CC=C3)Cl
COC(=O)c1c(NC(=O)C=Cc2cccc(c2)Cl)sc2c1CCCC2
InChI=1SC19H18ClNO3Sc12419(23)1714723815(14)2518(17)2116(22)1091254613(20)1112h46911H2378H21H3(H2122)b109+
methyl2(((2E)3(3chlorophenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(((E)3(3chlorophenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD03367726
ZINC000016246732
ZINC16246732
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