Vitas-M small molecule compound
5-{(Z)-[3-(4-methoxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL428727
SMILES COc1ccc(cc1)N1C(=S)S/C(=C\c2ccc3c(c2)n(C)c(=O)n3C)/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 C20H17N3O3S2 MW 411.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O3S2/c1-21-15-9-4-12(10-16(15)22(2)19(21)25)11-17-18(24)23(20(27)28-17)13-5-7-14(26-3)8-6-13/h4-11H,1-3H3/b17-11-InChIKey
PQQZKGWYUKBQGU-BOPFTXTBSA-NSynonyms
(5Z)5((13dimethyl2oxobenzimidazol5yl)methylidene)3(4methoxyphenyl)2sulfanylidene13thiazolidin4one
5((Z)(3(4methoxyphenyl)4oxo2thioxo13thiazolidin5ylidene)methyl)13dimethyl13dihydro2Hbenzimidazol2one
CN1C2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)C4=CC=C(C=C4)OC)N(C1=O)C
COc1ccc(cc1)N1C(=S)SC(=Cc2ccc3c(c2)n(C)c(=O)n3C)C1=O
InChI=1SC20H17N3O3S2c121159412(1016(15)22(2)19(21)25)111718(24)23(20(27)2817)135714(263)8613h411H13H3b1711
MFCD30710657
ZINC000033682859
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