(2S)-2-azanyl-N-[1,5-dimethyl-2,4-bis(oxidanylidene)-1,5-benzodiazepin-3-yl]pentanamide

Systemtic Name: (2S)-2-azanyl-N-[1,5-dimethyl-2,4-bis(oxidanylidene)-1,5-benzodiazepin-3-yl]pentanamide Openeye Name: (2S)-2-amino-N-(1,5-dimethyl-2,4-dioxo-1,5-benzodiazepin-3-yl)pentanamide CAS Name: (2S)-2-amino-N-(1,5-dimethyl-2,4-dioxo-1,5-benzodiazepin-3-yl)pentanamide IUPAC Name: (2S)-2-amino-N-(1,5-dimethyl-2,4-dioxo-1,5-benzodiazepin-3-yl)pentanamide Traditional Name: (2S)-2-amino-N-(2,4-diketo-1,5-dimethyl-1,5-benzodiazepin-3-yl)valeramide Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1C(=O)N(C2=CC=CC=C2N(C1=O)C)C)N

Isomeric SMILES

CCC[C@@H](C(=O)NC1C(=O)N(C2=CC=CC=C2N(C1=O)C)C)N

InChI

InChI=1S/C16H22N4O3/c1-4-7-10(17)14(21)18-13-15(22)19(2)11-8-5-6-9-12(11)20(3)16(13)23/h5-6,8-10,13H,4,7,17H2,1-3H3,(H,18,21)/t10-/m0/s1