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

Systemtic Name: 4-cyano-N-[2-(4-cyclopropylcarbonyl-1,4-diazepan-1-yl)-5-(1,4-diazepan-1-ylcarbonyl)phenyl]benzamide Openeye Name: 4-cyano-N-[2-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]benzamide CAS Name: 4-cyano-N-[2-[4-[cyclopropyl(oxo)methyl]-1,4-diazepan-1-yl]-5-[1,4-diazepan-1-yl(oxo)methyl]phenyl]benzamide IUPAC Name: 4-cyano-N-[2-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]benzamide Traditional Name: 4-cyano-N-[2-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]-5-(1,4-diazepane-1-carbonyl)phenyl]benzamide Formula: C29H34N6O3 MolecularWeight: 514.61866

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C2=CC(=C(C=C2)N3CCCN(CC3)C(=O)C4CC4)NC(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CNCCN(C1)C(=O)C2=CC(=C(C=C2)N3CCCN(CC3)C(=O)C4CC4)NC(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H34N6O3/c30-20-21-3-5-22(6-4-21)27(36)32-25-19-24(29(38)34-13-1-11-31-12-16-34)9-10-26(25)33-14-2-15-35(18-17-33)28(37)23-7-8-23/h3-6,9-10,19,23,31H,1-2,7-8,11-18H2,(H,32,36)