[1-oxidanylidene-1-(1,3-thiazol-2-ylamino)propan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-(1,3-thiazol-2-ylamino)propan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: [1-methyl-2-oxo-2-(thiazol-2-ylamino)ethyl] 4-(4-chlorophenyl)-2-methyl-1-oxo-isoquinoline-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-methyl-1-oxo-3-isoquinolinecarboxylic acid [1-oxo-1-(2-thiazolylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1,3-thiazol-2-ylamino)propan-2-yl] 4-(4-chlorophenyl)-2-methyl-1-oxoisoquinoline-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-1-keto-2-methyl-isoquinoline-3-carboxylic acid [2-keto-1-methyl-2-(thiazol-2-ylamino)ethyl] ester Formula: C23H18ClN3O4S MolecularWeight: 467.92472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=CS1)OC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C(=O)NC1=NC=CS1)OC(=O)C2=C(C3=CC=CC=C3C(=O)N2C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H18ClN3O4S/c1-13(20(28)26-23-25-11-12-32-23)31-22(30)19-18(14-7-9-15(24)10-8-14)16-5-3-4-6-17(16)21(29)27(19)2/h3-13H,1-2H3,(H,25,26,28)