methyl N-[5-piperazin-1-ylcarbonyl-2-(4-pyridin-4-ylcarbonylpiperazin-1-yl)phenyl]carbamate

Systemtic Name: methyl N-[5-piperazin-1-ylcarbonyl-2-(4-pyridin-4-ylcarbonylpiperazin-1-yl)phenyl]carbamate Openeye Name: methyl N-[5-(piperazine-1-carbonyl)-2-[4-(pyridine-4-carbonyl)piperazin-1-yl]phenyl]carbamate CAS Name: N-[5-[oxo(1-piperazinyl)methyl]-2-[4-[oxo(pyridin-4-yl)methyl]-1-piperazinyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[5-(piperazine-1-carbonyl)-2-[4-(pyridine-4-carbonyl)piperazin-1-yl]phenyl]carbamate Traditional Name: N-[2-(4-isonicotinoylpiperazino)-5-(piperazine-1-carbonyl)phenyl]carbamic acid methyl ester Formula: C23H28N6O4 MolecularWeight: 452.50622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=C(C=CC(=C1)C(=O)N2CCNCC2)N3CCN(CC3)C(=O)C4=CC=NC=C4

Isomeric SMILES

COC(=O)NC1=C(C=CC(=C1)C(=O)N2CCNCC2)N3CCN(CC3)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C23H28N6O4/c1-33-23(32)26-19-16-18(22(31)28-10-8-25-9-11-28)2-3-20(19)27-12-14-29(15-13-27)21(30)17-4-6-24-7-5-17/h2-7,16,25H,8-15H2,1H3,(H,26,32)