4-methyl-1-[2-(4-methylpyrimidin-2-yl)sulfanylethanoyl]-3H-1,4-benzodiazepine-2,5-dione

Systemtic Name: 4-methyl-1-[2-(4-methylpyrimidin-2-yl)sulfanylethanoyl]-3H-1,4-benzodiazepine-2,5-dione Openeye Name: 4-methyl-1-[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]-3H-1,4-benzodiazepine-2,5-dione CAS Name: 4-methyl-1-[2-[(4-methyl-2-pyrimidinyl)thio]-1-oxoethyl]-3H-1,4-benzodiazepine-2,5-dione IUPAC Name: 4-methyl-1-[2-(4-methylpyrimidin-2-yl)sulfanylacetyl]-3H-1,4-benzodiazepine-2,5-dione Traditional Name: 4-methyl-1-[2-[(4-methylpyrimidin-2-yl)thio]acetyl]-3H-1,4-benzodiazepine-2,5-quinone Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC(=O)N2C(=O)CN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CC1=NC(=NC=C1)SCC(=O)N2C(=O)CN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C17H16N4O3S/c1-11-7-8-18-17(19-11)25-10-15(23)21-13-6-4-3-5-12(13)16(24)20(2)9-14(21)22/h3-8H,9-10H2,1-2H3