3-(1H-indol-3-yl)-1-[3-(4-methylsulfanylphenyl)carbonylpiperidin-1-yl]propan-1-one

Systemtic Name: 3-(1H-indol-3-yl)-1-[3-(4-methylsulfanylphenyl)carbonylpiperidin-1-yl]propan-1-one Openeye Name: 3-(1H-indol-3-yl)-1-[3-(4-methylsulfanylbenzoyl)-1-piperidyl]propan-1-one CAS Name: 3-(1H-indol-3-yl)-1-[3-[[4-(methylthio)phenyl]-oxomethyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-(1H-indol-3-yl)-1-[3-(4-methylsulfanylbenzoyl)piperidin-1-yl]propan-1-one Traditional Name: 3-(1H-indol-3-yl)-1-[3-[4-(methylthio)benzoyl]piperidino]propan-1-one Formula: C24H26N2O2S MolecularWeight: 406.54044

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)C2CCCN(C2)C(=O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)C2CCCN(C2)C(=O)CCC3=CNC4=CC=CC=C43

InChI

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