3-(2-ethanoylcyclopropyl)-1-(4-methylphenyl)sulfonyl-indole-5-carbonitrile

Systemtic Name: 3-(2-ethanoylcyclopropyl)-1-(4-methylphenyl)sulfonyl-indole-5-carbonitrile Openeye Name: 3-(2-acetylcyclopropyl)-1-(p-tolylsulfonyl)indole-5-carbonitrile CAS Name: 3-(2-acetylcyclopropyl)-1-(4-methylphenyl)sulfonyl-5-indolecarbonitrile IUPAC Name: 3-(2-acetylcyclopropyl)-1-(4-methylphenyl)sulfonylindole-5-carbonitrile Traditional Name: 3-(2-acetylcyclopropyl)-1-tosyl-indole-5-carbonitrile Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)C#N)C4CC4C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)C#N)C4CC4C(=O)C

InChI

InChI=1S/C21H18N2O3S/c1-13-3-6-16(7-4-13)27(25,26)23-12-20(18-10-17(18)14(2)24)19-9-15(11-22)5-8-21(19)23/h3-9,12,17-18H,10H2,1-2H3