5-ethyl-2-[(5-methyl-4-piperidin-1-yl-pyridin-2-yl)methylsulfanyl]-1H-indole

Systemtic Name: 5-ethyl-2-[(5-methyl-4-piperidin-1-yl-pyridin-2-yl)methylsulfanyl]-1H-indole Openeye Name: 5-ethyl-2-[[5-methyl-4-(1-piperidyl)-2-pyridyl]methylsulfanyl]-1H-indole CAS Name: 5-ethyl-2-[[5-methyl-4-(1-piperidinyl)-2-pyridinyl]methylthio]-1H-indole IUPAC Name: 5-ethyl-2-[(5-methyl-4-piperidin-1-ylpyridin-2-yl)methylsulfanyl]-1H-indole Traditional Name: 5-ethyl-2-[(5-methyl-4-piperidino-2-pyridyl)methylthio]-1H-indole Formula: C22H27N3S MolecularWeight: 365.53488

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=C2)SCC3=NC=C(C(=C3)N4CCCCC4)C

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=C2)SCC3=NC=C(C(=C3)N4CCCCC4)C

InChI

InChI=1S/C22H27N3S/c1-3-17-7-8-20-18(11-17)12-22(24-20)26-15-19-13-21(16(2)14-23-19)25-9-5-4-6-10-25/h7-8,11-14,24H,3-6,9-10,15H2,1-2H3