6,6-dimethyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1H-pyrazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one

Systemtic Name: 6,6-dimethyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1H-pyrazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one Openeye Name: 6,6-dimethyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1H-pyrazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one CAS Name: 6,6-dimethyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-1-(1H-pyrazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one IUPAC Name: 6,6-dimethyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(1H-pyrazol-5-yl)-5,7-dihydro-2-benzothiophen-4-one Traditional Name: 6,6-dimethyl-3-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-1-(1H-pyrazol-5-yl)-5,7-dihydroisobenzothiophen-4-one Formula: C16H16N4OS3 MolecularWeight: 376.51944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SC2=C3C(=C(S2)C4=CC=NN4)CC(CC3=O)(C)C

Isomeric SMILES

CC1=NN=C(S1)SC2=C3C(=C(S2)C4=CC=NN4)CC(CC3=O)(C)C

InChI

InChI=1S/C16H16N4OS3/c1-8-18-20-15(22-8)24-14-12-9(6-16(2,3)7-11(12)21)13(23-14)10-4-5-17-19-10/h4-5H,6-7H2,1-3H3,(H,17,19)