4-[3-[4-(2,3-dihydroindol-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-[4-(2,3-dihydroindol-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 4-[2-hydroxy-3-(4-indolin-1-ylsulfonyl-3,5-dimethyl-pyrazol-1-yl)propoxy]benzonitrile CAS Name: 4-[3-[4-(2,3-dihydroindol-1-ylsulfonyl)-3,5-dimethyl-1-pyrazolyl]-2-hydroxypropoxy]benzonitrile IUPAC Name: 4-[3-[4-(2,3-dihydroindol-1-ylsulfonyl)-3,5-dimethylpyrazol-1-yl]-2-hydroxypropoxy]benzonitrile Traditional Name: 4-[2-hydroxy-3-(4-indolin-1-ylsulfonyl-3,5-dimethyl-pyrazol-1-yl)propoxy]benzonitrile Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(COC2=CC=C(C=C2)C#N)O)C)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=NN1CC(COC2=CC=C(C=C2)C#N)O)C)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C23H24N4O4S/c1-16-23(32(29,30)27-12-11-19-5-3-4-6-22(19)27)17(2)26(25-16)14-20(28)15-31-21-9-7-18(13-24)8-10-21/h3-10,20,28H,11-12,14-15H2,1-2H3