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

Systemtic Name: N-[2-[4-[2-(4-methoxyphenyl)ethanoyl]-1,4-diazepan-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]-2-phenyl-ethanamide Openeye Name: N-[2-[4-[2-(4-methoxyphenyl)acetyl]-1,4-diazepan-1-yl]-5-(piperazine-1-carbonyl)phenyl]-2-phenyl-acetamide CAS Name: N-[2-[4-[2-(4-methoxyphenyl)-1-oxoethyl]-1,4-diazepan-1-yl]-5-[oxo(1-piperazinyl)methyl]phenyl]-2-phenylacetamide IUPAC Name: N-[2-[4-[2-(4-methoxyphenyl)acetyl]-1,4-diazepan-1-yl]-5-(piperazine-1-carbonyl)phenyl]-2-phenylacetamide Traditional Name: N-[2-[4-[2-(4-methoxyphenyl)acetyl]-1,4-diazepan-1-yl]-5-(piperazine-1-carbonyl)phenyl]-2-phenyl-acetamide Formula: C33H39N5O4 MolecularWeight: 569.69386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)N2CCCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCNCC4)NC(=O)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)N2CCCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCNCC4)NC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C33H39N5O4/c1-42-28-11-8-26(9-12-28)23-32(40)37-17-5-16-36(20-21-37)30-13-10-27(33(41)38-18-14-34-15-19-38)24-29(30)35-31(39)22-25-6-3-2-4-7-25/h2-4,6-13,24,34H,5,14-23H2,1H3,(H,35,39)