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

Systemtic Name: (4S)-4-methyl-5-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: (4S)-4-methyl-5-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylacetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: (4S)-4-methyl-5-[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]-1-oxoethyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: (4S)-4-methyl-5-[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: (4S)-4-methyl-5-[2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC(=CC(=N3)C)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CC(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC(=CC(=N3)C)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O2S/c1-15-12-19(17-8-4-3-5-9-17)26-23(24-15)30-14-22(29)27-16(2)13-21(28)25-18-10-6-7-11-20(18)27/h3-12,16H,13-14H2,1-2H3,(H,25,28)/t16-/m0/s1