methyl 2-[[1-(4-methylphenyl)-5-oxidanylidene-2-thiophen-2-yl-pyrrolidin-3-yl]carbonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[[1-(4-methylphenyl)-5-oxidanylidene-2-thiophen-2-yl-pyrrolidin-3-yl]carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[5-oxo-1-(p-tolyl)-2-(2-thienyl)pyrrolidine-3-carbonyl]amino]thiazole-5-carboxylate CAS Name: 2-[[[1-(4-methylphenyl)-5-oxo-2-thiophen-2-yl-3-pyrrolidinyl]-oxomethyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[1-(4-methylphenyl)-5-oxo-2-thiophen-2-ylpyrrolidine-3-carbonyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[[5-keto-1-(p-tolyl)-2-(2-thienyl)pyrrolidine-3-carbonyl]amino]thiazole-5-carboxylic acid methyl ester Formula: C21H19N3O4S2 MolecularWeight: 441.52326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CC2=O)C(=O)NC3=NC=C(S3)C(=O)OC)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(CC2=O)C(=O)NC3=NC=C(S3)C(=O)OC)C4=CC=CS4

InChI

InChI=1S/C21H19N3O4S2/c1-12-5-7-13(8-6-12)24-17(25)10-14(18(24)15-4-3-9-29-15)19(26)23-21-22-11-16(30-21)20(27)28-2/h3-9,11,14,18H,10H2,1-2H3,(H,22,23,26)