Vitas-M small molecule compound
4-[(5Z)-5-(1-{2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoic acid
Catalog ID
STK814995
SMILES OC(=O)CCCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2C)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 C25H23N3O5S2 MW 509.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O5S2/c1-14-9-10-17(15(2)12-14)26-19(29)13-28-18-7-4-3-6-16(18)21(23(28)32)22-24(33)27(25(34)35-22)11-5-8-20(30)31/h3-4,6-7,9-10,12H,5,8,11,13H2,1-2H3,(H,26,29)(H,30,31)/b22-21-InChIKey
AZKZKZXYJNYZAP-DQRAZIAOSA-NSynonyms
4((5Z)5(1(2((24dimethylphenyl)amino)2oxoethyl)2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4((5Z)5(1(2(24DIMETHYLANILINO)2OXOETHYL)2OXOINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
CC1=CC(=C(C=C1)NC(=O)CN2C3=CC=CC=C3C(=C4C(=O)N(C(=S)S4)CCCC(=O)O)C2=O)C
InChI=1SC25H23N3O5S2c11491017(15(2)1214)2619(29)132818743616(18)21(23(28)32)2224(33)27(25(34)3522)115820(30)31h346791012H581113H212H3(H2629)(H3031)b2221
MFCD05151874
OC(=O)CCCN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2C)C)C1=O
ZINC000016731977
ZINC16731977
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