4-methyl-N-[3-(2-methylsulfonyl-3-thiophen-2-yl-3,4-dihydropyrazol-5-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[3-(2-methylsulfonyl-3-thiophen-2-yl-3,4-dihydropyrazol-5-yl)phenyl]benzenesulfonamide Openeye Name: 4-methyl-N-[3-[2-methylsulfonyl-3-(2-thienyl)-3,4-dihydropyrazol-5-yl]phenyl]benzenesulfonamide CAS Name: 4-methyl-N-[3-(2-methylsulfonyl-3-thiophen-2-yl-3,4-dihydropyrazol-5-yl)phenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[3-(2-methylsulfonyl-3-thiophen-2-yl-3,4-dihydropyrazol-5-yl)phenyl]benzenesulfonamide Traditional Name: N-[3-[1-mesyl-5-(2-thienyl)-2-pyrazolin-3-yl]phenyl]-4-methyl-benzenesulfonamide Formula: C21H21N3O4S3 MolecularWeight: 475.60414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=NN(C(C3)C4=CC=CS4)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C3=NN(C(C3)C4=CC=CS4)S(=O)(=O)C

InChI

InChI=1S/C21H21N3O4S3/c1-15-8-10-18(11-9-15)31(27,28)23-17-6-3-5-16(13-17)19-14-20(21-7-4-12-29-21)24(22-19)30(2,25)26/h3-13,20,23H,14H2,1-2H3