Vitas-M small molecule compound
2-({[(5Z)-5-(2-chlorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL297984
SMILES O=C(Nc1sc2c(c1C(=O)N)CCCC2)CN1C(=O)S/C(=C\c2ccccc2Cl)/C1=O
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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 C21H18ClN3O4S2 MW 475.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O4S2/c22-13-7-3-1-5-11(13)9-15-20(28)25(21(29)31-15)10-16(26)24-19-17(18(23)27)12-6-2-4-8-14(12)30-19/h1,3,5,7,9H,2,4,6,8,10H2,(H2,23,27)(H,24,26)/b15-9-InChIKey
TXPFZVWPQRLDNI-DHDCSXOGSA-NSynonyms
301305-09-9(Z)2(2(5(2chlorobenzylidene)24dioxothiazolidin3yl)acetamido)4567tetrahydrobenzo(b)thiophene3carboxamide
2((((5Z)5(2chlorobenzylidene)24dioxo13thiazolidin3yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxamide
2((2((5Z)5((2chlorophenyl)methylidene)24dioxo13thiazolidin3yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxamide
301305099
C1CCC2=C(C1)C(=C(S2)NC(=O)CN3C(=O)C(=CC4=CC=CC=C4Cl)SC3=O)C(=O)N
InChI=1SC21H18ClN3O4S2c2213731511(13)91520(28)25(21(29)3115)1016(26)241917(18(23)27)12624814(12)3019h13579H246810H2(H22327)(H2426)b159
MFCD01162146
O=C(Nc1sc2c(c1C(=O)N)CCCC2)CN1C(=O)SC(=Cc2ccccc2Cl)C1=O
ZINC000001776424
ZINC01776424
ZINC1776424
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