3-carbamimidoyl-N-[(1R)-2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]benzamide

Systemtic Name: 3-carbamimidoyl-N-[(1R)-2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]benzamide Openeye Name: 3-carbamimidoyl-N-[(1R)-2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxo-1-phenyl-ethyl]benzamide CAS Name: 3-carbamimidoyl-N-[(1R)-2-[4-(4-chlorophenyl)-1-piperazinyl]-2-oxo-1-phenylethyl]benzamide IUPAC Name: 3-carbamimidoyl-N-[(1R)-2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxo-1-phenylethyl]benzamide Traditional Name: 3-amidino-N-[(1R)-2-[4-(4-chlorophenyl)piperazino]-2-keto-1-phenyl-ethyl]benzamide Formula: C26H26ClN5O2 MolecularWeight: 475.96994

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)C(=O)C(C3=CC=CC=C3)NC(=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)C(=O)[C@@H](C3=CC=CC=C3)NC(=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C26H26ClN5O2/c27-21-9-11-22(12-10-21)31-13-15-32(16-14-31)26(34)23(18-5-2-1-3-6-18)30-25(33)20-8-4-7-19(17-20)24(28)29/h1-12,17,23H,13-16H2,(H3,28,29)(H,30,33)/t23-/m1/s1