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

Systemtic Name: 4-[[4-(2,3-dihydroindol-1-ylsulfonyl)-3,5-dimethyl-pyrazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[(4-indolin-1-ylsulfonyl-3,5-dimethyl-pyrazol-1-yl)methyl]benzonitrile CAS Name: 4-[[4-(2,3-dihydroindol-1-ylsulfonyl)-3,5-dimethyl-1-pyrazolyl]methyl]benzonitrile IUPAC Name: 4-[[4-(2,3-dihydroindol-1-ylsulfonyl)-3,5-dimethylpyrazol-1-yl]methyl]benzonitrile Traditional Name: 4-[(4-indolin-1-ylsulfonyl-3,5-dimethyl-pyrazol-1-yl)methyl]benzonitrile Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C#N)C)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C#N)C)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C21H20N4O2S/c1-15-21(28(26,27)25-12-11-19-5-3-4-6-20(19)25)16(2)24(23-15)14-18-9-7-17(13-22)8-10-18/h3-10H,11-12,14H2,1-2H3