4-(5-methylsulfanyl-1H-indol-3-yl)-1-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)butan-1-one

Systemtic Name: 4-(5-methylsulfanyl-1H-indol-3-yl)-1-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)butan-1-one Openeye Name: 4-(5-methylsulfanyl-1H-indol-3-yl)-1-[4-(2-thienyl)-1,2,3,6-tetrahydropyridin-2-yl]butan-1-one CAS Name: 4-[5-(methylthio)-1H-indol-3-yl]-1-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)-1-butanone IUPAC Name: 4-(5-methylsulfanyl-1H-indol-3-yl)-1-(4-thiophen-2-yl-1,2,3,6-tetrahydropyridin-2-yl)butan-1-one Traditional Name: 4-[5-(methylthio)-1H-indol-3-yl]-1-[4-(2-thienyl)-1,2,3,6-tetrahydropyridin-2-yl]butan-1-one Formula: C22H24N2OS2 MolecularWeight: 396.56876

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)NC=C2CCCC(=O)C3CC(=CCN3)C4=CC=CS4

Isomeric SMILES

CSC1=CC2=C(C=C1)NC=C2CCCC(=O)C3CC(=CCN3)C4=CC=CS4

InChI

InChI=1S/C22H24N2OS2/c1-26-17-7-8-19-18(13-17)16(14-24-19)4-2-5-21(25)20-12-15(9-10-23-20)22-6-3-11-27-22/h3,6-9,11,13-14,20,23-24H,2,4-5,10,12H2,1H3