4-[3-[(3-chloranyl-4-cyano-phenyl)amino]-3-oxidanylidene-propyl]-N,N-dimethyl-piperazine-1-carboxamide

Systemtic Name: 4-[3-[(3-chloranyl-4-cyano-phenyl)amino]-3-oxidanylidene-propyl]-N,N-dimethyl-piperazine-1-carboxamide Openeye Name: 4-[3-(3-chloro-4-cyano-anilino)-3-oxo-propyl]-N,N-dimethyl-piperazine-1-carboxamide CAS Name: 4-[3-(3-chloro-4-cyanoanilino)-3-oxopropyl]-N,N-dimethyl-1-piperazinecarboxamide IUPAC Name: 4-[3-(3-chloro-4-cyanoanilino)-3-oxopropyl]-N,N-dimethylpiperazine-1-carboxamide Traditional Name: 4-[3-(3-chloro-4-cyano-anilino)-3-keto-propyl]-N,N-dimethyl-piperazine-1-carboxamide Formula: C17H22ClN5O2 MolecularWeight: 363.84188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1CCN(CC1)CCC(=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CN(C)C(=O)N1CCN(CC1)CCC(=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C17H22ClN5O2/c1-21(2)17(25)23-9-7-22(8-10-23)6-5-16(24)20-14-4-3-13(12-19)15(18)11-14/h3-4,11H,5-10H2,1-2H3,(H,20,24)