Vitas-M small molecule compound
N-(2,5-dimethylphenyl)-2-[(3Z)-3-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-2-oxo-2,3-dihydro-1H-indol-1-yl]acetamide
Catalog ID
STK816082
SMILES COc1ccc(cc1)CCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)Nc2cc(C)ccc2C)/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 C30H27N3O4S2 MW 557.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O4S2/c1-18-8-9-19(2)23(16-18)31-25(34)17-33-24-7-5-4-6-22(24)26(28(33)35)27-29(36)32(30(38)39-27)15-14-20-10-12-21(37-3)13-11-20/h4-13,16H,14-15,17H2,1-3H3,(H,31,34)/b27-26-InChIKey
WTYSTRKFKWZFTQ-RQZHXJHFSA-NSynonyms
CC1=CC(=C(C=C1)C)NC(=O)CN2C3=CC=CC=C3C(=C4C(=O)N(C(=S)S4)CCC5=CC=C(C=C5)OC)C2=O
COc1ccc(cc1)CCN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)Nc2cc(C)ccc2C)C1=O
InChI=1SC30H27N3O4S2c1188919(2)23(1618)3125(34)173324754622(24)26(28(33)35)2729(36)32(30(38)3927)151420101221(373)131120h41316H141517H213H3(H3134)b2726
MFCD06642684
N(25DIMETHYLPHENYL)2((3Z)3(3(2(4METHOXYPHENYL)ETHYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)2OXOINDOL1YL)ACETAMIDE
N(25dimethylphenyl)2((3Z)3(3(2(4methoxyphenyl)ethyl)4oxo2thioxo13thiazolidin5ylidene)2oxo23dihydro1Hindol1yl)acetamide
ZINC000097946547
ZINC97946547
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