methyl 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfinylmethyl]-1H-indole-5-carboxylate

Systemtic Name: methyl 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfinylmethyl]-1H-indole-5-carboxylate Openeye Name: methyl 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfinylmethyl]-1H-indole-5-carboxylate CAS Name: 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfinylmethyl]-1H-indole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfinylmethyl]-1H-indole-5-carboxylate Traditional Name: 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfinylmethyl]-1H-indole-5-carboxylic acid methyl ester Formula: C24H26N2O3S MolecularWeight: 422.53984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC=C2CS(=O)CCC3CC(=CCN3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC=C2CS(=O)CCC3CC(=CCN3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O3S/c1-29-24(27)19-7-8-23-22(14-19)20(15-26-23)16-30(28)12-10-21-13-18(9-11-25-21)17-5-3-2-4-6-17/h2-9,14-15,21,25-26H,10-13,16H2,1H3