2-(1-methyl-3-thiophen-2-yl-pyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(1-methyl-3-thiophen-2-yl-pyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[1-methyl-3-(2-thienyl)pyrazol-4-yl]sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(1-methyl-3-thiophen-2-yl-4-pyrazolyl)sulfonyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(1-methyl-3-thiophen-2-ylpyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[1-methyl-3-(2-thienyl)pyrazol-4-yl]sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C17H17N3O2S2 MolecularWeight: 359.46578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=CS2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=CS2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C17H17N3O2S2/c1-19-12-16(17(18-19)15-7-4-10-23-15)24(21,22)20-9-8-13-5-2-3-6-14(13)11-20/h2-7,10,12H,8-9,11H2,1H3