(4S)-4-methyl-5-[2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: (4S)-4-methyl-5-[2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: (4S)-4-methyl-5-[2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: (4S)-4-methyl-5-[1-oxo-2-[(6-oxo-1H-pyrimidin-2-yl)thio]ethyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: (4S)-4-methyl-5-[2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: (4S)-5-[2-[(6-keto-1H-pyrimidin-2-yl)thio]acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C16H16N4O3S MolecularWeight: 344.38824

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC=CC(=O)N3

Isomeric SMILES

C[C@H]1CC(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC=CC(=O)N3

InChI

InChI=1S/C16H16N4O3S/c1-10-8-14(22)18-11-4-2-3-5-12(11)20(10)15(23)9-24-16-17-7-6-13(21)19-16/h2-7,10H,8-9H2,1H3,(H,18,22)(H,17,19,21)/t10-/m0/s1