3-[2-(2-diethylaminoethyl)cyclopropyl]-1-(4-methylphenyl)sulfonyl-indole-5-carbonitrile

Systemtic Name: 3-[2-(2-diethylaminoethyl)cyclopropyl]-1-(4-methylphenyl)sulfonyl-indole-5-carbonitrile Openeye Name: 3-[2-(2-diethylaminoethyl)cyclopropyl]-1-(p-tolylsulfonyl)indole-5-carbonitrile CAS Name: 3-[2-(2-diethylaminoethyl)cyclopropyl]-1-(4-methylphenyl)sulfonyl-5-indolecarbonitrile IUPAC Name: 3-[2-(2-diethylaminoethyl)cyclopropyl]-1-(4-methylphenyl)sulfonylindole-5-carbonitrile Traditional Name: 3-[2-(2-diethylaminoethyl)cyclopropyl]-1-tosyl-indole-5-carbonitrile Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1CC1C2=CN(C3=C2C=C(C=C3)C#N)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCN(CC)CCC1CC1C2=CN(C3=C2C=C(C=C3)C#N)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H29N3O2S/c1-4-27(5-2)13-12-20-15-22(20)24-17-28(25-11-8-19(16-26)14-23(24)25)31(29,30)21-9-6-18(3)7-10-21/h6-11,14,17,20,22H,4-5,12-13,15H2,1-3H3