1-[4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]carbonylphenyl]urea

Systemtic Name: 1-[4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]carbonylphenyl]urea Openeye Name: [4-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]phenyl]urea CAS Name: [4-[[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]urea IUPAC Name: [4-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]phenyl]urea Traditional Name: [4-[4-(4-cyanobenzyl)piperazine-1-carbonyl]phenyl]urea Formula: C20H21N5O2 MolecularWeight: 363.41304

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC=C(C=C3)NC(=O)N

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC=C(C=C3)NC(=O)N

InChI

InChI=1S/C20H21N5O2/c21-13-15-1-3-16(4-2-15)14-24-9-11-25(12-10-24)19(26)17-5-7-18(8-6-17)23-20(22)27/h1-8H,9-12,14H2,(H3,22,23,27)