3-azanyl-5-[2-(2-methylphenyl)-2-oxidanylidene-ethyl]-1-(phenylmethyl)-2,3-dihydro-1,5-benzodiazepin-4-one

Systemtic Name: 3-azanyl-5-[2-(2-methylphenyl)-2-oxidanylidene-ethyl]-1-(phenylmethyl)-2,3-dihydro-1,5-benzodiazepin-4-one Openeye Name: 3-amino-1-benzyl-5-[2-(o-tolyl)-2-oxo-ethyl]-2,3-dihydro-1,5-benzodiazepin-4-one CAS Name: 3-amino-5-[2-(2-methylphenyl)-2-oxoethyl]-1-(phenylmethyl)-2,3-dihydro-1,5-benzodiazepin-4-one IUPAC Name: 3-amino-1-benzyl-5-[2-(2-methylphenyl)-2-oxoethyl]-2,3-dihydro-1,5-benzodiazepin-4-one Traditional Name: 3-amino-1-benzyl-5-[2-keto-2-(o-tolyl)ethyl]-2,3-dihydro-1,5-benzodiazepin-4-one Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)CN2C3=CC=CC=C3N(CC(C2=O)N)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)CN2C3=CC=CC=C3N(CC(C2=O)N)CC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O2/c1-18-9-5-6-12-20(18)24(29)17-28-23-14-8-7-13-22(23)27(16-21(26)25(28)30)15-19-10-3-2-4-11-19/h2-14,21H,15-17,26H2,1H3