N-[4-[2-(4-methylphenyl)sulfonyl-3-thiophen-2-yl-3,4-dihydropyrazol-5-yl]phenyl]ethanamide

Systemtic Name: N-[4-[2-(4-methylphenyl)sulfonyl-3-thiophen-2-yl-3,4-dihydropyrazol-5-yl]phenyl]ethanamide Openeye Name: N-[4-[2-(p-tolylsulfonyl)-3-(2-thienyl)-3,4-dihydropyrazol-5-yl]phenyl]acetamide CAS Name: N-[4-[2-(4-methylphenyl)sulfonyl-3-thiophen-2-yl-3,4-dihydropyrazol-5-yl]phenyl]acetamide IUPAC Name: N-[4-[2-(4-methylphenyl)sulfonyl-3-thiophen-2-yl-3,4-dihydropyrazol-5-yl]phenyl]acetamide Traditional Name: N-[4-[5-(2-thienyl)-1-tosyl-2-pyrazolin-3-yl]phenyl]acetamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C3=CC=C(C=C3)NC(=O)C)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C3=CC=C(C=C3)NC(=O)C)C4=CC=CS4

InChI

InChI=1S/C22H21N3O3S2/c1-15-5-11-19(12-6-15)30(27,28)25-21(22-4-3-13-29-22)14-20(24-25)17-7-9-18(10-8-17)23-16(2)26/h3-13,21H,14H2,1-2H3,(H,23,26)