3-[N-(2-chlorophenyl)-C-(4-prop-1-en-2-ylpiperazin-1-yl)carbonimidoyl]-N,N-diethyl-benzamide

Systemtic Name: 3-[N-(2-chlorophenyl)-C-(4-prop-1-en-2-ylpiperazin-1-yl)carbonimidoyl]-N,N-diethyl-benzamide Openeye Name: 3-[N-(2-chlorophenyl)-C-(4-isopropenylpiperazin-1-yl)carbonimidoyl]-N,N-diethyl-benzamide CAS Name: 3-[(2-chlorophenyl)imino-[4-(1-methylethenyl)-1-piperazinyl]methyl]-N,N-diethylbenzamide IUPAC Name: 3-[N-(2-chlorophenyl)-C-(4-prop-1-en-2-ylpiperazin-1-yl)carbonimidoyl]-N,N-diethylbenzamide Traditional Name: 3-[N-(2-chlorophenyl)-C-(4-isopropenylpiperazino)carbonimidoyl]-N,N-diethyl-benzamide Formula: C25H31ClN4O MolecularWeight: 438.99284

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=CC(=C1)C(=NC2=CC=CC=C2Cl)N3CCN(CC3)C(=C)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=CC(=C1)C(=NC2=CC=CC=C2Cl)N3CCN(CC3)C(=C)C

InChI

InChI=1S/C25H31ClN4O/c1-5-28(6-2)25(31)21-11-9-10-20(18-21)24(27-23-13-8-7-12-22(23)26)30-16-14-29(15-17-30)19(3)4/h7-13,18H,3,5-6,14-17H2,1-2,4H3