2-[4-[2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-2-phenyl-ethanamide

Systemtic Name: 2-[4-[2-[(5-chloranyl-2-cyano-phenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-2-phenyl-ethanamide Openeye Name: 2-[4-[2-(5-chloro-2-cyano-anilino)-2-oxo-ethyl]piperazin-1-yl]-2-phenyl-acetamide CAS Name: 2-[4-[2-(5-chloro-2-cyanoanilino)-2-oxoethyl]-1-piperazinyl]-2-phenylacetamide IUPAC Name: 2-[4-[2-(5-chloro-2-cyanoanilino)-2-oxoethyl]piperazin-1-yl]-2-phenylacetamide Traditional Name: 2-[4-[2-(5-chloro-2-cyano-anilino)-2-keto-ethyl]piperazino]-2-phenyl-acetamide Formula: C21H22ClN5O2 MolecularWeight: 411.88468

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=C(C=CC(=C2)Cl)C#N)C(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=C(C=CC(=C2)Cl)C#N)C(C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C21H22ClN5O2/c22-17-7-6-16(13-23)18(12-17)25-19(28)14-26-8-10-27(11-9-26)20(21(24)29)15-4-2-1-3-5-15/h1-7,12,20H,8-11,14H2,(H2,24,29)(H,25,28)