1-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]sulfonyl-3,4-dihydro-2H-quinoline

Systemtic Name: 1-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]sulfonyl-3,4-dihydro-2H-quinoline Openeye Name: 1-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]sulfonyl-3,4-dihydro-2H-quinoline CAS Name: 1-[[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]sulfonyl]-3,4-dihydro-2H-quinoline IUPAC Name: 1-(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)sulfonyl-3,4-dihydro-2H-quinoline Traditional Name: 1-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]sulfonyl-3,4-dihydro-2H-quinoline Formula: C23H21N3O2S2 MolecularWeight: 435.56174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C23H21N3O2S2/c27-30(28,26-14-6-11-19-10-4-5-12-20(19)26)22-17-25(16-18-8-2-1-3-9-18)24-23(22)21-13-7-15-29-21/h1-5,7-10,12-13,15,17H,6,11,14,16H2