1-[3-[[4-(2,3-dihydroindol-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]methyl]-4-ethoxy-phenyl]ethanone

Systemtic Name: 1-[3-[[4-(2,3-dihydroindol-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]methyl]-4-ethoxy-phenyl]ethanone Openeye Name: 1-[4-ethoxy-3-[(4-indolin-1-ylsulfonyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]ethanone CAS Name: 1-[3-[[4-(2,3-dihydroindol-1-ylsulfonyl)-3,5-dimethyl-1-pyrazolyl]methyl]-4-ethoxyphenyl]ethanone IUPAC Name: 1-[3-[[4-(2,3-dihydroindol-1-ylsulfonyl)-3,5-dimethylpyrazol-1-yl]methyl]-4-ethoxyphenyl]ethanone Traditional Name: 1-[4-ethoxy-3-[(4-indolin-1-ylsulfonyl-3,5-dimethyl-pyrazol-1-yl)methyl]phenyl]ethanone Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CN2C(=C(C(=N2)C)S(=O)(=O)N3CCC4=CC=CC=C43)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CN2C(=C(C(=N2)C)S(=O)(=O)N3CCC4=CC=CC=C43)C

InChI

InChI=1S/C24H27N3O4S/c1-5-31-23-11-10-20(18(4)28)14-21(23)15-26-17(3)24(16(2)25-26)32(29,30)27-13-12-19-8-6-7-9-22(19)27/h6-11,14H,5,12-13,15H2,1-4H3