Vitas-M small molecule compound
3-({3-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)benzoic acid
Catalog ID
STK535021
SMILES O=C(Nc1cccc(c1)C(=O)O)CCN1C(=S)S/C(=C\c2ccc(cc2)C)/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 C21H18N2O4S2 MW 426.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O4S2/c1-13-5-7-14(8-6-13)11-17-19(25)23(21(28)29-17)10-9-18(24)22-16-4-2-3-15(12-16)20(26)27/h2-8,11-12H,9-10H2,1H3,(H,22,24)(H,26,27)/b17-11-InChIKey
WJWBVNIJPMKGJW-BOPFTXTBSA-NSynonyms
6615-95-8(Z)3(3(5(4methylbenzylidene)4oxo2thioxothiazolidin3yl)propanamido)benzoicacid
3((3((5Z)5(4methylbenzylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)amino)benzoicacid
3(3((5Z)4OXO5(PTOLYLMETHYLENE)2THIOXOTHIAZOLIDIN3YL)PROPANOYLAMINO)BENZOICACID
3(3((5Z)5((4METHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOYLAMINO)BENZOICACID
3(3(4OXO2THIOXO5(1PTOLYLMETH(Z)YLIDENE)THIAZOLIDIN3YL)PROPIONYLAMINO)BENZOICACID
6615958
BENZOICACID3((3((5Z)5((4METHYLPHENYL)METHYLENE)4OXO2THIOXO3THIAZOLIDINYL)1OXOPROPYL)AMINO)
CC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)NC3=CC=CC(=C3)C(=O)O
InChI=1SC21H18N2O4S2c1135714(8613)111719(25)23(21(28)2917)10918(24)221642315(1216)20(26)27h281112H910H21H3(H2224)(H2627)b1711
MFCD02369763
O=C(Nc1cccc(c1)C(=O)O)CCN1C(=S)SC(=Cc2ccc(cc2)C)C1=O
ZINC000013606953
ZINC13606953
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