(2S)-2-azanyl-N-(1-methyl-2-oxidanylidene-5-propan-2-yl-3H-1,4-benzodiazepin-3-yl)propanamide

Systemtic Name: (2S)-2-azanyl-N-(1-methyl-2-oxidanylidene-5-propan-2-yl-3H-1,4-benzodiazepin-3-yl)propanamide Openeye Name: (2S)-2-amino-N-(5-isopropyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl)propanamide CAS Name: (2S)-2-amino-N-(1-methyl-2-oxo-5-propan-2-yl-3H-1,4-benzodiazepin-3-yl)propanamide IUPAC Name: (2S)-2-amino-N-(1-methyl-2-oxo-5-propan-2-yl-3H-1,4-benzodiazepin-3-yl)propanamide Traditional Name: (2S)-2-amino-N-(5-isopropyl-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl)propionamide Formula: C16H22N4O2 MolecularWeight: 302.37148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(C(=O)N(C2=CC=CC=C21)C)NC(=O)C(C)N

Isomeric SMILES

C[C@@H](C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C(C)C)C)N

InChI

InChI=1S/C16H22N4O2/c1-9(2)13-11-7-5-6-8-12(11)20(4)16(22)14(18-13)19-15(21)10(3)17/h5-10,14H,17H2,1-4H3,(H,19,21)/t10-,14?/m0/s1