(phenylmethyl) N-[5-piperazin-1-ylcarbonyl-2-(4-pyridin-3-ylcarbonylpiperazin-1-yl)phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[5-piperazin-1-ylcarbonyl-2-(4-pyridin-3-ylcarbonylpiperazin-1-yl)phenyl]carbamate Openeye Name: benzyl N-[5-(piperazine-1-carbonyl)-2-[4-(pyridine-3-carbonyl)piperazin-1-yl]phenyl]carbamate CAS Name: N-[5-[oxo(1-piperazinyl)methyl]-2-[4-[oxo(3-pyridinyl)methyl]-1-piperazinyl]phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[5-(piperazine-1-carbonyl)-2-[4-(pyridine-3-carbonyl)piperazin-1-yl]phenyl]carbamate Traditional Name: N-[2-(4-nicotinoylpiperazino)-5-(piperazine-1-carbonyl)phenyl]carbamic acid benzyl ester Formula: C29H32N6O4 MolecularWeight: 528.60218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CN=CC=C4)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CN=CC=C4)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C29H32N6O4/c36-27(34-13-11-30-12-14-34)23-8-9-26(25(19-23)32-29(38)39-21-22-5-2-1-3-6-22)33-15-17-35(18-16-33)28(37)24-7-4-10-31-20-24/h1-10,19-20,30H,11-18,21H2,(H,32,38)