N-[2-methyl-5-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]phenyl]benzamide

Systemtic Name: N-[2-methyl-5-[[4-(phenylmethyl)-1,4-diazepan-1-yl]carbonyl]phenyl]benzamide Openeye Name: N-[5-(4-benzyl-1,4-diazepane-1-carbonyl)-2-methyl-phenyl]benzamide CAS Name: N-[2-methyl-5-[oxo-[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]phenyl]benzamide IUPAC Name: N-[5-(4-benzyl-1,4-diazepane-1-carbonyl)-2-methylphenyl]benzamide Traditional Name: N-[5-(4-benzyl-1,4-diazepane-1-carbonyl)-2-methyl-phenyl]benzamide Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2/c1-21-13-14-24(19-25(21)28-26(31)23-11-6-3-7-12-23)27(32)30-16-8-15-29(17-18-30)20-22-9-4-2-5-10-22/h2-7,9-14,19H,8,15-18,20H2,1H3,(H,28,31)