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

Systemtic Name: methyl 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-4-carboxylate Openeye Name: methyl 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-4-carboxylate CAS Name: 3-[[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylthio]methyl]-1H-indole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-4-carboxylate Traditional Name: 3-[[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylthio]methyl]-1H-indole-4-carboxylic acid methyl ester Formula: C24H26N2O2S MolecularWeight: 406.54044

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=CC=C1)NC=C2CSCCC3CC(=CCN3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C2C(=CC=C1)NC=C2CSCCC3CC(=CCN3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2O2S/c1-28-24(27)21-8-5-9-22-23(21)19(15-26-22)16-29-13-11-20-14-18(10-12-25-20)17-6-3-2-4-7-17/h2-10,15,20,25-26H,11-14,16H2,1H3