2-(4-methoxyphenyl)-N-[6-[4-(4-methylphenyl)carbonyl-1,4-diazepan-1-yl]pyridin-3-yl]ethanamide

Systemtic Name: 2-(4-methoxyphenyl)-N-[6-[4-(4-methylphenyl)carbonyl-1,4-diazepan-1-yl]pyridin-3-yl]ethanamide Openeye Name: 2-(4-methoxyphenyl)-N-[6-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]-3-pyridyl]acetamide CAS Name: 2-(4-methoxyphenyl)-N-[6-[4-[(4-methylphenyl)-oxomethyl]-1,4-diazepan-1-yl]-3-pyridinyl]acetamide IUPAC Name: 2-(4-methoxyphenyl)-N-[6-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]pyridin-3-yl]acetamide Traditional Name: 2-(4-methoxyphenyl)-N-[6-(4-p-toluoyl-1,4-diazepan-1-yl)-3-pyridyl]acetamide Formula: C27H30N4O3 MolecularWeight: 458.5521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C3=NC=C(C=C3)NC(=O)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C3=NC=C(C=C3)NC(=O)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C27H30N4O3/c1-20-4-8-22(9-5-20)27(33)31-15-3-14-30(16-17-31)25-13-10-23(19-28-25)29-26(32)18-21-6-11-24(34-2)12-7-21/h4-13,19H,3,14-18H2,1-2H3,(H,29,32)