4-cyano-N-[2-(4-cyclobutylcarbonylpiperazin-1-yl)-5-(1,4-diazepan-1-ylcarbonyl)phenyl]benzamide

Systemtic Name: 4-cyano-N-[2-(4-cyclobutylcarbonylpiperazin-1-yl)-5-(1,4-diazepan-1-ylcarbonyl)phenyl]benzamide Openeye Name: 4-cyano-N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]benzamide CAS Name: 4-cyano-N-[2-[4-[cyclobutyl(oxo)methyl]-1-piperazinyl]-5-[1,4-diazepan-1-yl(oxo)methyl]phenyl]benzamide IUPAC Name: 4-cyano-N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]benzamide Traditional Name: 4-cyano-N-[2-[4-(cyclobutanecarbonyl)piperazino]-5-(1,4-diazepane-1-carbonyl)phenyl]benzamide Formula: C29H34N6O3 MolecularWeight: 514.61866

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCCNCC4)NC(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CC(C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCCNCC4)NC(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H34N6O3/c30-20-21-5-7-22(8-6-21)27(36)32-25-19-24(29(38)34-13-2-11-31-12-14-34)9-10-26(25)33-15-17-35(18-16-33)28(37)23-3-1-4-23/h5-10,19,23,31H,1-4,11-18H2,(H,32,36)