2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)sulfonyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonyl-3,4-dihydro-1H-isoquinoline Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H21N3O2S/c1-15-20(16(2)23(21-15)19-10-4-3-5-11-19)26(24,25)22-13-12-17-8-6-7-9-18(17)14-22/h3-11H,12-14H2,1-2H3