2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-1,5-dimethyl-4-propan-2-yl-pyrazol-3-one

Systemtic Name: 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-1,5-dimethyl-4-propan-2-yl-pyrazol-3-one Openeye Name: 2-(4-indolin-1-ylsulfonylphenyl)-4-isopropyl-1,5-dimethyl-pyrazol-3-one CAS Name: 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-1,5-dimethyl-4-propan-2-yl-3-pyrazolone IUPAC Name: 2-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-1,5-dimethyl-4-propan-2-ylpyrazol-3-one Traditional Name: 2-(4-indolin-1-ylsulfonylphenyl)-4-isopropyl-1,5-dimethyl-3-pyrazolin-3-one Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43)C(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C43)C(C)C

InChI

InChI=1S/C22H25N3O3S/c1-15(2)21-16(3)23(4)25(22(21)26)18-9-11-19(12-10-18)29(27,28)24-14-13-17-7-5-6-8-20(17)24/h5-12,15H,13-14H2,1-4H3