5-[(4-butan-2-ylphenyl)methyl]-3-methyl-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one

Systemtic Name: 5-[(4-butan-2-ylphenyl)methyl]-3-methyl-1-(phenylcarbonyl)-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 1-benzoyl-3-methyl-5-[(4-sec-butylphenyl)methyl]-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 1-benzoyl-5-[(4-butan-2-ylphenyl)methyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 1-benzoyl-5-[(4-butan-2-ylphenyl)methyl]-3-methyl-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 1-benzoyl-3-methyl-5-(4-sec-butylbenzyl)-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C28H30N2O2 MolecularWeight: 426.55

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N(CC(C2=O)C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N(CC(C2=O)C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H30N2O2/c1-4-20(2)23-16-14-22(15-17-23)19-30-26-13-9-8-12-25(26)29(18-21(3)27(30)31)28(32)24-10-6-5-7-11-24/h5-17,20-21H,4,18-19H2,1-3H3