2-(4-chlorophenyl)-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]thiazole-4-carboxamide CAS Name: 2-(4-chlorophenyl)-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-4-thiazolecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-N-[4-(3-ketopiperazino)benzyl]thiazole-4-carboxamide Formula: C21H19ClN4O2S MolecularWeight: 426.91916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)C3=CSC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)C3=CSC(=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H19ClN4O2S/c22-16-5-3-15(4-6-16)21-25-18(13-29-21)20(28)24-11-14-1-7-17(8-2-14)26-10-9-23-19(27)12-26/h1-8,13H,9-12H2,(H,23,27)(H,24,28)