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

Systemtic Name: 2-[(5-butyl-4-piperidin-1-yl-pyridin-2-yl)methylsulfanyl]-1H-indole Openeye Name: 2-[[5-butyl-4-(1-piperidyl)-2-pyridyl]methylsulfanyl]-1H-indole CAS Name: 2-[[5-butyl-4-(1-piperidinyl)-2-pyridinyl]methylthio]-1H-indole IUPAC Name: 2-[(5-butyl-4-piperidin-1-ylpyridin-2-yl)methylsulfanyl]-1H-indole Traditional Name: 2-[(5-butyl-4-piperidino-2-pyridyl)methylthio]-1H-indole Formula: C23H29N3S MolecularWeight: 379.56146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(C=C1N2CCCCC2)CSC3=CC4=CC=CC=C4N3

Isomeric SMILES

CCCCC1=CN=C(C=C1N2CCCCC2)CSC3=CC4=CC=CC=C4N3

InChI

InChI=1S/C23H29N3S/c1-2-3-9-19-16-24-20(15-22(19)26-12-7-4-8-13-26)17-27-23-14-18-10-5-6-11-21(18)25-23/h5-6,10-11,14-16,25H,2-4,7-9,12-13,17H2,1H3