5-(4-chlorophenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]thiophene-2-carboxamide

Systemtic Name: 5-(4-chlorophenyl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]thiophene-2-carboxamide Openeye Name: 5-(4-chlorophenyl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]thiophene-2-carboxamide CAS Name: 5-(4-chlorophenyl)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-2-thiophenecarboxamide IUPAC Name: 5-(4-chlorophenyl)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]thiophene-2-carboxamide Traditional Name: 5-(4-chlorophenyl)-N-[6-(3-ketopiperazino)-3-pyridyl]thiophene-2-carboxamide Formula: C20H17ClN4O2S MolecularWeight: 412.89258

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=CC=C(S3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=CC=C(S3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H17ClN4O2S/c21-14-3-1-13(2-4-14)16-6-7-17(28-16)20(27)24-15-5-8-18(23-11-15)25-10-9-22-19(26)12-25/h1-8,11H,9-10,12H2,(H,22,26)(H,24,27)