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

Systemtic Name: 2-[(5-ethyl-4-piperidin-1-yl-pyridin-2-yl)methylsulfinyl]-1H-indole Openeye Name: 2-[[5-ethyl-4-(1-piperidyl)-2-pyridyl]methylsulfinyl]-1H-indole CAS Name: 2-[[5-ethyl-4-(1-piperidinyl)-2-pyridinyl]methylsulfinyl]-1H-indole IUPAC Name: 2-[(5-ethyl-4-piperidin-1-ylpyridin-2-yl)methylsulfinyl]-1H-indole Traditional Name: 2-[(5-ethyl-4-piperidino-2-pyridyl)methylsulfinyl]-1H-indole Formula: C21H25N3OS MolecularWeight: 367.5077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1N2CCCCC2)CS(=O)C3=CC4=CC=CC=C4N3

Isomeric SMILES

CCC1=CN=C(C=C1N2CCCCC2)CS(=O)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C21H25N3OS/c1-2-16-14-22-18(13-20(16)24-10-6-3-7-11-24)15-26(25)21-12-17-8-4-5-9-19(17)23-21/h4-5,8-9,12-14,23H,2-3,6-7,10-11,15H2,1H3