4-(1H-indol-3-ylmethylsulfanyl)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butan-1-one

Systemtic Name: 4-(1H-indol-3-ylmethylsulfanyl)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butan-1-one Openeye Name: 4-(1H-indol-3-ylmethylsulfanyl)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butan-1-one CAS Name: 4-(1H-indol-3-ylmethylthio)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)-1-butanone IUPAC Name: 4-(1H-indol-3-ylmethylsulfanyl)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butan-1-one Traditional Name: 4-(1H-indol-3-ylmethylthio)-1-(4-phenyl-1,2,3,6-tetrahydropyridin-2-yl)butan-1-one Formula: C24H26N2OS MolecularWeight: 390.54104

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CC(N1)C(=O)CCCSCC2=CNC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1C=C(CC(N1)C(=O)CCCSCC2=CNC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2OS/c27-24(23-15-19(12-13-25-23)18-7-2-1-3-8-18)11-6-14-28-17-20-16-26-22-10-5-4-9-21(20)22/h1-5,7-10,12,16,23,25-26H,6,11,13-15,17H2