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

Systemtic Name: 2-(2,3-dimethoxyphenyl)-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(2,3-dimethoxyphenyl)-N-[4-(3-oxopiperazin-1-yl)phenyl]thiazole-4-carboxamide CAS Name: 2-(2,3-dimethoxyphenyl)-N-[4-(3-oxo-1-piperazinyl)phenyl]-4-thiazolecarboxamide IUPAC Name: 2-(2,3-dimethoxyphenyl)-N-[4-(3-oxopiperazin-1-yl)phenyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(2,3-dimethoxyphenyl)-N-[4-(3-ketopiperazino)phenyl]thiazole-4-carboxamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=NC(=CS2)C(=O)NC3=CC=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=NC(=CS2)C(=O)NC3=CC=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C22H22N4O4S/c1-29-18-5-3-4-16(20(18)30-2)22-25-17(13-31-22)21(28)24-14-6-8-15(9-7-14)26-11-10-23-19(27)12-26/h3-9,13H,10-12H2,1-2H3,(H,23,27)(H,24,28)