(2S)-2-azanyl-3-methyl-N-(1-methyl-2-oxidanylidene-5-phenyl-3,4-dihydro-1,5-benzodiazepin-3-yl)butanamide

Systemtic Name: (2S)-2-azanyl-3-methyl-N-(1-methyl-2-oxidanylidene-5-phenyl-3,4-dihydro-1,5-benzodiazepin-3-yl)butanamide Openeye Name: (2S)-2-amino-3-methyl-N-(1-methyl-2-oxo-5-phenyl-3,4-dihydro-1,5-benzodiazepin-3-yl)butanamide CAS Name: (2S)-2-amino-3-methyl-N-(1-methyl-2-oxo-5-phenyl-3,4-dihydro-1,5-benzodiazepin-3-yl)butanamide IUPAC Name: (2S)-2-amino-3-methyl-N-(1-methyl-2-oxo-5-phenyl-3,4-dihydro-1,5-benzodiazepin-3-yl)butanamide Traditional Name: (2S)-2-amino-N-(2-keto-1-methyl-5-phenyl-3,4-dihydro-1,5-benzodiazepin-3-yl)-3-methyl-butyramide Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CN(C2=CC=CC=C2N(C1=O)C)C3=CC=CC=C3)N

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1CN(C2=CC=CC=C2N(C1=O)C)C3=CC=CC=C3)N

InChI

InChI=1S/C21H26N4O2/c1-14(2)19(22)20(26)23-16-13-25(15-9-5-4-6-10-15)18-12-8-7-11-17(18)24(3)21(16)27/h4-12,14,16,19H,13,22H2,1-3H3,(H,23,26)/t16?,19-/m0/s1