(phenylmethyl) 2-[2-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: (phenylmethyl) 2-[2-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)butanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: benzyl 2-[2-(4,8-dimethyl-2-oxo-1-quinolyl)butanoylamino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-(4,8-dimethyl-2-oxo-1-quinolinyl)-1-oxobutyl]amino]-4-methyl-5-thiazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(4,8-dimethyl-2-oxoquinolin-1-yl)butanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-(2-keto-4,8-dimethyl-1-quinolyl)butanoylamino]-4-methyl-thiazole-5-carboxylic acid benzyl ester Formula: C27H27N3O4S MolecularWeight: 489.58598

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC2=CC=CC=C2)C)N3C(=O)C=C(C4=C3C(=CC=C4)C)C

Isomeric SMILES

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC2=CC=CC=C2)C)N3C(=O)C=C(C4=C3C(=CC=C4)C)C

InChI

InChI=1S/C27H27N3O4S/c1-5-21(30-22(31)14-17(3)20-13-9-10-16(2)23(20)30)25(32)29-27-28-18(4)24(35-27)26(33)34-15-19-11-7-6-8-12-19/h6-14,21H,5,15H2,1-4H3,(H,28,29,32)