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

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2-(4-ethoxyphenyl)-1,3-thiazole-4-carboxamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-2-(4-ethoxyphenyl)thiazole-4-carboxamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-2-(4-ethoxyphenyl)-4-thiazolecarboxamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-2-(4-ethoxyphenyl)-1,3-thiazole-4-carboxamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-2-p-phenetyl-thiazole-4-carboxamide Formula: C22H21ClN4O3S MolecularWeight: 456.94514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC3=CC(=C(C=C3)N4CCNC(=O)C4)Cl

InChI

InChI=1S/C22H21ClN4O3S/c1-2-30-16-6-3-14(4-7-16)22-26-18(13-31-22)21(29)25-15-5-8-19(17(23)11-15)27-10-9-24-20(28)12-27/h3-8,11,13H,2,9-10,12H2,1H3,(H,24,28)(H,25,29)