ethyl 5-methoxy-3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-6-carboxylate

Systemtic Name: ethyl 5-methoxy-3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-6-carboxylate Openeye Name: ethyl 5-methoxy-3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-6-carboxylate CAS Name: 5-methoxy-3-[[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylthio]methyl]-1H-indole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methoxy-3-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylsulfanylmethyl]-1H-indole-6-carboxylate Traditional Name: 5-methoxy-3-[[2-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)ethylthio]methyl]-1H-indole-6-carboxylic acid ethyl ester Formula: C26H30N2O3S MolecularWeight: 450.593

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C2C(=C1)NC=C2CSCCC3CC(=CCN3)C4=CC=CC=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(C=C2C(=C1)NC=C2CSCCC3CC(=CCN3)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H30N2O3S/c1-3-31-26(29)23-14-24-22(15-25(23)30-2)20(16-28-24)17-32-12-10-21-13-19(9-11-27-21)18-7-5-4-6-8-18/h4-9,14-16,21,27-28H,3,10-13,17H2,1-2H3