2-[[4-(azepan-1-ylmethyl)phenyl]carbonylamino]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 2-[[4-(azepan-1-ylmethyl)phenyl]carbonylamino]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-[[4-(azepan-1-ylmethyl)benzoyl]amino]-N-(3-pyridylmethyl)benzamide CAS Name: 2-[[[4-(1-azepanylmethyl)phenyl]-oxomethyl]amino]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-[[4-(azepan-1-ylmethyl)benzoyl]amino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-[[4-(azepan-1-ylmethyl)benzoyl]amino]-N-(3-pyridylmethyl)benzamide Formula: C27H30N4O2 MolecularWeight: 442.5527

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C27H30N4O2/c32-26(23-13-11-21(12-14-23)20-31-16-5-1-2-6-17-31)30-25-10-4-3-9-24(25)27(33)29-19-22-8-7-15-28-18-22/h3-4,7-15,18H,1-2,5-6,16-17,19-20H2,(H,29,33)(H,30,32)