N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-methyl-quinoline-8-sulfonamide

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-methyl-quinoline-8-sulfonamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-methyl-quinoline-8-sulfonamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-methyl-8-quinolinesulfonamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-methylquinoline-8-sulfonamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-methyl-quinoline-8-sulfonamide Formula: C22H22N4O2S MolecularWeight: 406.50068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)NCC3=C(N(N=C3C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)NCC3=C(N(N=C3C)C4=CC=CC=C4)C

InChI

InChI=1S/C22H22N4O2S/c1-15-12-18-8-7-11-21(22(18)23-13-15)29(27,28)24-14-20-16(2)25-26(17(20)3)19-9-5-4-6-10-19/h4-13,24H,14H2,1-3H3