(3S)-3-(2-methylpropyl)-5-naphthalen-2-yl-1-(phenylmethyl)-3H-1,4-benzodiazepin-2-one

Systemtic Name: (3S)-3-(2-methylpropyl)-5-naphthalen-2-yl-1-(phenylmethyl)-3H-1,4-benzodiazepin-2-one Openeye Name: (3S)-1-benzyl-3-isobutyl-5-(2-naphthyl)-3H-1,4-benzodiazepin-2-one CAS Name: (3S)-3-(2-methylpropyl)-5-(2-naphthalenyl)-1-(phenylmethyl)-3H-1,4-benzodiazepin-2-one IUPAC Name: (3S)-1-benzyl-3-(2-methylpropyl)-5-naphthalen-2-yl-3H-1,4-benzodiazepin-2-one Traditional Name: (3S)-1-benzyl-3-isobutyl-5-(2-naphthyl)-3H-1,4-benzodiazepin-2-one Formula: C30H28N2O MolecularWeight: 432.55612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC4=CC=CC=C4C=C3)CC5=CC=CC=C5

Isomeric SMILES

CC(C)C[C@H]1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC4=CC=CC=C4C=C3)CC5=CC=CC=C5

InChI

InChI=1S/C30H28N2O/c1-21(2)18-27-30(33)32(20-22-10-4-3-5-11-22)28-15-9-8-14-26(28)29(31-27)25-17-16-23-12-6-7-13-24(23)19-25/h3-17,19,21,27H,18,20H2,1-2H3/t27-/m0/s1