Vitas-M small molecule compound
4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(4-nitrophenyl)butanamide
Catalog ID
STK836877
SMILES O=C(Nc1ccc(cc1)[N+](=O)[O-])CCCN1C(=S)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 C20H16ClN3O4S2 MW 461.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN3O4S2/c21-16-5-2-1-4-13(16)12-17-19(26)23(20(29)30-17)11-3-6-18(25)22-14-7-9-15(10-8-14)24(27)28/h1-2,4-5,7-10,12H,3,6,11H2,(H,22,25)/b17-12-InChIKey
LBPFMDMTSRAFQH-ATVHPVEESA-NSynonyms
(Z)4(5(2chlorobenzylidene)4oxo2thioxothiazolidin3yl)N(4nitrophenyl)butanamide
4((5Z)5((2CHLOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)N(4NITROPHENYL)BUTANAMIDE
4((5Z)5(2chlorobenzylidene)4oxo2thioxo13thiazolidin3yl)N(4nitrophenyl)butanamide
C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=CC=C(C=C3)(N+)(=O)(O))Cl
InChI=1SC20H16ClN3O4S2c2116521413(16)121719(26)23(20(29)3017)113618(25)22147915(10814)24(27)28h124571012H3611H2(H2225)b1712
MFCD02370056
O=C(Nc1ccc(cc1)(N+)(=O)(O))CCCN1C(=S)SC(=Cc2ccccc2Cl)C1=O
ZINC000008714034
ZINC08714034
ZINC8714034
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