Vitas-M small molecule compound
2-{[(2E)-3-(3-chlorophenyl)prop-2-enoyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Catalog ID
STK440266
SMILES Clc1cccc(c1)/C=C/C(=O)Nc1sc2c(c1C(=O)N)CCCCCC2
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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 C20H21ClN2O2S MW 388.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN2O2S/c21-14-7-5-6-13(12-14)10-11-17(24)23-20-18(19(22)25)15-8-3-1-2-4-9-16(15)26-20/h5-7,10-12H,1-4,8-9H2,(H2,22,25)(H,23,24)/b11-10+InChIKey
BMUIBUTWXWSWHR-ZHACJKMWSA-NSynonyms
2(((2E)3(3chlorophenyl)prop2enoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
2(((E)3(3chlorophenyl)prop2enoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxamide
C1CCCC2=C(CC1)C(=C(S2)NC(=O)C=CC3=CC(=CC=C3)Cl)C(=O)N
Clc1cccc(c1)C=CC(=O)Nc1sc2c(c1C(=O)N)CCCCCC2
InChI=1SC20H21ClN2O2Sc211475613(1214)101117(24)232018(19(22)25)1583124916(15)2620h571012H1489H2(H22225)(H2324)b1110+
MFCD01350031
ZINC000000996128
ZINC00996128
ZINC996128
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