3-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-5-(2-ethoxyphenyl)sulfanyl-1H-indole

Systemtic Name: 3-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-5-(2-ethoxyphenyl)sulfanyl-1H-indole Openeye Name: 3-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-5-(2-ethoxyphenyl)sulfanyl-1H-indole CAS Name: 3-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-5-[(2-ethoxyphenyl)thio]-1H-indole IUPAC Name: 3-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-5-(2-ethoxyphenyl)sulfanyl-1H-indole Traditional Name: 3-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-5-(o-phenetylthio)-1H-indole Formula: C25H30N2OS MolecularWeight: 406.5835

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1SC2=CC3=C(C=C2)NC=C3C4=CCN(CC4)C(C)(C)C

Isomeric SMILES

CCOC1=CC=CC=C1SC2=CC3=C(C=C2)NC=C3C4=CCN(CC4)C(C)(C)C

InChI

InChI=1S/C25H30N2OS/c1-5-28-23-8-6-7-9-24(23)29-19-10-11-22-20(16-19)21(17-26-22)18-12-14-27(15-13-18)25(2,3)4/h6-12,16-17,26H,5,13-15H2,1-4H3