2-(4-methoxyphenyl)-N-[2-[4-(phenylcarbonyl)-1,4-diazepan-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]ethanamide

Systemtic Name: 2-(4-methoxyphenyl)-N-[2-[4-(phenylcarbonyl)-1,4-diazepan-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]ethanamide Openeye Name: N-[2-(4-benzoyl-1,4-diazepan-1-yl)-5-(piperazine-1-carbonyl)phenyl]-2-(4-methoxyphenyl)acetamide CAS Name: N-[2-(4-benzoyl-1,4-diazepan-1-yl)-5-[oxo(1-piperazinyl)methyl]phenyl]-2-(4-methoxyphenyl)acetamide IUPAC Name: N-[2-(4-benzoyl-1,4-diazepan-1-yl)-5-(piperazine-1-carbonyl)phenyl]-2-(4-methoxyphenyl)acetamide Traditional Name: N-[2-(4-benzoyl-1,4-diazepan-1-yl)-5-(piperazine-1-carbonyl)phenyl]-2-(4-methoxyphenyl)acetamide Formula: C32H37N5O4 MolecularWeight: 555.66728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC2=C(C=CC(=C2)C(=O)N3CCNCC3)N4CCCN(CC4)C(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC2=C(C=CC(=C2)C(=O)N3CCNCC3)N4CCCN(CC4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C32H37N5O4/c1-41-27-11-8-24(9-12-27)22-30(38)34-28-23-26(32(40)37-18-14-33-15-19-37)10-13-29(28)35-16-5-17-36(21-20-35)31(39)25-6-3-2-4-7-25/h2-4,6-13,23,33H,5,14-22H2,1H3,(H,34,38)