3-azanyl-1-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-1-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-1-[2-(2-naphthyl)-2-oxo-ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-1-[2-(2-naphthalenyl)-2-oxoethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-1-(2-naphthalen-2-yl-2-oxoethyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-1-[2-keto-2-(2-naphthyl)ethyl]-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C27H21N3O2 MolecularWeight: 419.47454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=CC=CC=C32)CC(=O)C4=CC5=CC=CC=C5C=C4)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=CC=CC=C32)CC(=O)C4=CC5=CC=CC=C5C=C4)N

InChI

InChI=1S/C27H21N3O2/c28-26-27(32)30(17-24(31)21-15-14-18-8-4-5-11-20(18)16-21)23-13-7-6-12-22(23)25(29-26)19-9-2-1-3-10-19/h1-16,26H,17,28H2