9-methyl-4-(6-phenylsulfanylpyridin-3-yl)-4,9-diazabicyclo[4.2.1]nonane

Systemtic Name: 9-methyl-4-(6-phenylsulfanylpyridin-3-yl)-4,9-diazabicyclo[4.2.1]nonane Openeye Name: 9-methyl-4-(6-phenylsulfanyl-3-pyridyl)-4,9-diazabicyclo[4.2.1]nonane CAS Name: 9-methyl-4-[6-(phenylthio)-3-pyridinyl]-4,9-diazabicyclo[4.2.1]nonane IUPAC Name: 9-methyl-4-(6-phenylsulfanylpyridin-3-yl)-4,9-diazabicyclo[4.2.1]nonane Traditional Name: 9-methyl-4-[6-(phenylthio)-3-pyridyl]-4,9-diazabicyclo[4.2.1]nonane Formula: C19H23N3S MolecularWeight: 325.47102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1CN(CC2)C3=CN=C(C=C3)SC4=CC=CC=C4

Isomeric SMILES

CN1C2CCC1CN(CC2)C3=CN=C(C=C3)SC4=CC=CC=C4

InChI

InChI=1S/C19H23N3S/c1-21-15-7-8-17(21)14-22(12-11-15)16-9-10-19(20-13-16)23-18-5-3-2-4-6-18/h2-6,9-10,13,15,17H,7-8,11-12,14H2,1H3