1-[5-methyl-2-[(3-methyl-4-piperidin-1-yl-pyridin-2-yl)methylsulfanyl]-1H-indol-6-yl]ethanone

Systemtic Name: 1-[5-methyl-2-[(3-methyl-4-piperidin-1-yl-pyridin-2-yl)methylsulfanyl]-1H-indol-6-yl]ethanone Openeye Name: 1-[5-methyl-2-[[3-methyl-4-(1-piperidyl)-2-pyridyl]methylsulfanyl]-1H-indol-6-yl]ethanone CAS Name: 1-[5-methyl-2-[[3-methyl-4-(1-piperidinyl)-2-pyridinyl]methylthio]-1H-indol-6-yl]ethanone IUPAC Name: 1-[5-methyl-2-[(3-methyl-4-piperidin-1-ylpyridin-2-yl)methylsulfanyl]-1H-indol-6-yl]ethanone Traditional Name: 1-[5-methyl-2-[(3-methyl-4-piperidino-2-pyridyl)methylthio]-1H-indol-6-yl]ethanone Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(N2)SCC3=NC=CC(=C3C)N4CCCCC4)C(=O)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(N2)SCC3=NC=CC(=C3C)N4CCCCC4)C(=O)C

InChI

InChI=1S/C23H27N3OS/c1-15-11-18-12-23(25-20(18)13-19(15)17(3)27)28-14-21-16(2)22(7-8-24-21)26-9-5-4-6-10-26/h7-8,11-13,25H,4-6,9-10,14H2,1-3H3