(10aS)-2-(1,3-dimethylpyrazol-4-yl)-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-1-one

Systemtic Name: (10aS)-2-(1,3-dimethylpyrazol-4-yl)-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-1-one Openeye Name: (10aS)-2-(1,3-dimethylpyrazol-4-yl)-3-thioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-1-one CAS Name: (10aS)-2-(1,3-dimethyl-4-pyrazolyl)-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-1-one IUPAC Name: (10aS)-2-(1,3-dimethylpyrazol-4-yl)-3-sulfanylidene-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-1-one Traditional Name: (10aS)-2-(1,3-dimethylpyrazol-4-yl)-3-thioxo-10,10a-dihydro-5H-imidaz[1,5-b]isoquinolin-1-one Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1N2C(=O)C3CC4=CC=CC=C4CN3C2=S)C

Isomeric SMILES

CC1=NN(C=C1N2C(=O)[C@@H]3CC4=CC=CC=C4CN3C2=S)C

InChI

InChI=1S/C16H16N4OS/c1-10-14(9-18(2)17-10)20-15(21)13-7-11-5-3-4-6-12(11)8-19(13)16(20)22/h3-6,9,13H,7-8H2,1-2H3/t13-/m0/s1