methyl 4-[2-[(4-cyanophenyl)carbonylamino]-4-piperazin-1-ylcarbonyl-phenyl]piperazine-1-carboxylate

Systemtic Name: methyl 4-[2-[(4-cyanophenyl)carbonylamino]-4-piperazin-1-ylcarbonyl-phenyl]piperazine-1-carboxylate Openeye Name: methyl 4-[2-[(4-cyanobenzoyl)amino]-4-(piperazine-1-carbonyl)phenyl]piperazine-1-carboxylate CAS Name: 4-[2-[[(4-cyanophenyl)-oxomethyl]amino]-4-[oxo(1-piperazinyl)methyl]phenyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-cyanobenzoyl)amino]-4-(piperazine-1-carbonyl)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(4-cyanobenzoyl)amino]-4-(piperazine-1-carbonyl)phenyl]piperazine-1-carboxylic acid methyl ester Formula: C25H28N6O4 MolecularWeight: 476.52762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCNCC3)NC(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

COC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCNCC3)NC(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H28N6O4/c1-35-25(34)31-14-12-29(13-15-31)22-7-6-20(24(33)30-10-8-27-9-11-30)16-21(22)28-23(32)19-4-2-18(17-26)3-5-19/h2-7,16,27H,8-15H2,1H3,(H,28,32)