1-(3-cyanophenyl)carbonyl-N-(furan-2-ylmethyl)-4-(phenylmethyl)piperazine-2-carboxamide

Systemtic Name: 1-(3-cyanophenyl)carbonyl-N-(furan-2-ylmethyl)-4-(phenylmethyl)piperazine-2-carboxamide Openeye Name: 4-benzyl-1-(3-cyanobenzoyl)-N-(2-furylmethyl)piperazine-2-carboxamide CAS Name: 1-[(3-cyanophenyl)-oxomethyl]-N-(2-furanylmethyl)-4-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: 4-benzyl-1-(3-cyanobenzoyl)-N-(furan-2-ylmethyl)piperazine-2-carboxamide Traditional Name: 4-benzyl-1-(3-cyanobenzoyl)-N-(2-furfuryl)piperazine-2-carboxamide Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC2=CC=CC=C2)C(=O)NCC3=CC=CO3)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(C(CN1CC2=CC=CC=C2)C(=O)NCC3=CC=CO3)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C25H24N4O3/c26-15-20-8-4-9-21(14-20)25(31)29-12-11-28(17-19-6-2-1-3-7-19)18-23(29)24(30)27-16-22-10-5-13-32-22/h1-10,13-14,23H,11-12,16-18H2,(H,27,30)