1-[(4S)-4-methyl-2-sulfanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethanone

Systemtic Name: 1-[(4S)-4-methyl-2-sulfanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethanone Openeye Name: 1-[(4S)-4-methyl-2-thioxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethanone CAS Name: 1-[(4S)-4-methyl-2-sulfanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethanone IUPAC Name: 1-[(4S)-4-methyl-2-sulfanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethanone Traditional Name: 1-[(4S)-4-methyl-2-thioxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl]ethanone Formula: C12H14N2OS MolecularWeight: 234.31736

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=S)NC2=CC=CC=C2N1C(=O)C

Isomeric SMILES

C[C@H]1CC(=S)NC2=CC=CC=C2N1C(=O)C

InChI

InChI=1S/C12H14N2OS/c1-8-7-12(16)13-10-5-3-4-6-11(10)14(8)9(2)15/h3-6,8H,7H2,1-2H3,(H,13,16)/t8-/m0/s1