2-methyl-N-[3-methyl-1-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-methyl-N-[3-methyl-1-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-methyl-N-[2-methyl-1-[4-(p-tolylmethyl)-1,4-diazepane-1-carbonyl]propyl]benzamide CAS Name: 2-methyl-N-[3-methyl-1-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-1-oxobutan-2-yl]benzamide IUPAC Name: 2-methyl-N-[3-methyl-1-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-1-oxobutan-2-yl]benzamide Traditional Name: 2-methyl-N-[2-methyl-1-[4-(4-methylbenzyl)-1,4-diazepane-1-carbonyl]propyl]benzamide Formula: C26H35N3O2 MolecularWeight: 421.575

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C(C(C)C)NC(=O)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C(C(C)C)NC(=O)C3=CC=CC=C3C

InChI

InChI=1S/C26H35N3O2/c1-19(2)24(27-25(30)23-9-6-5-8-21(23)4)26(31)29-15-7-14-28(16-17-29)18-22-12-10-20(3)11-13-22/h5-6,8-13,19,24H,7,14-18H2,1-4H3,(H,27,30)