3-[2-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfonylmethyl]-1H-indole-5-carbonitrile

Systemtic Name: 3-[2-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfonylmethyl]-1H-indole-5-carbonitrile Openeye Name: 3-[2-[4-(2-thienyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfonylmethyl]-1H-indole-5-carbonitrile CAS Name: 3-[2-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfonylmethyl]-1H-indole-5-carbonitrile IUPAC Name: 3-[2-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfonylmethyl]-1H-indole-5-carbonitrile Traditional Name: 3-[2-[4-(2-thienyl)-1,2,3,6-tetrahydropyridin-2-yl]ethylsulfonylmethyl]-1H-indole-5-carbonitrile Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CC(N1)CCS(=O)(=O)CC2=CNC3=C2C=C(C=C3)C#N)C4=CC=CS4

Isomeric SMILES

C1C=C(CC(N1)CCS(=O)(=O)CC2=CNC3=C2C=C(C=C3)C#N)C4=CC=CS4

InChI

InChI=1S/C21H21N3O2S2/c22-12-15-3-4-20-19(10-15)17(13-24-20)14-28(25,26)9-6-18-11-16(5-7-23-18)21-2-1-8-27-21/h1-5,8,10,13,18,23-24H,6-7,9,11,14H2