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

Systemtic Name: 5-azanyl-2-[4-(4-chlorophenyl)carbonyl-1,4-diazepan-1-yl]-N-methyl-N-(phenylmethyl)benzamide Openeye Name: 5-amino-N-benzyl-2-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]-N-methyl-benzamide CAS Name: 5-amino-2-[4-[(4-chlorophenyl)-oxomethyl]-1,4-diazepan-1-yl]-N-methyl-N-(phenylmethyl)benzamide IUPAC Name: 5-amino-N-benzyl-2-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]-N-methylbenzamide Traditional Name: 5-amino-N-benzyl-2-[4-(4-chlorobenzoyl)-1,4-diazepan-1-yl]-N-methyl-benzamide Formula: C27H29ClN4O2 MolecularWeight: 476.99776

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=C(C=CC(=C2)N)N3CCCN(CC3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=C(C=CC(=C2)N)N3CCCN(CC3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H29ClN4O2/c1-30(19-20-6-3-2-4-7-20)27(34)24-18-23(29)12-13-25(24)31-14-5-15-32(17-16-31)26(33)21-8-10-22(28)11-9-21/h2-4,6-13,18H,5,14-17,19,29H2,1H3