3-(4-piperidin-1-ylphenyl)-6-(pyridin-4-ylmethylsulfanyl)pyridazine

Systemtic Name: 3-(4-piperidin-1-ylphenyl)-6-(pyridin-4-ylmethylsulfanyl)pyridazine Openeye Name: 3-[4-(1-piperidyl)phenyl]-6-(4-pyridylmethylsulfanyl)pyridazine CAS Name: 3-[4-(1-piperidinyl)phenyl]-6-(pyridin-4-ylmethylthio)pyridazine IUPAC Name: 3-(4-piperidin-1-ylphenyl)-6-(pyridin-4-ylmethylsulfanyl)pyridazine Traditional Name: 3-(4-piperidinophenyl)-6-(4-pyridylmethylthio)pyridazine Formula: C21H22N4S MolecularWeight: 362.49118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C3=NN=C(C=C3)SCC4=CC=NC=C4

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)C3=NN=C(C=C3)SCC4=CC=NC=C4

InChI

InChI=1S/C21H22N4S/c1-2-14-25(15-3-1)19-6-4-18(5-7-19)20-8-9-21(24-23-20)26-16-17-10-12-22-13-11-17/h4-13H,1-3,14-16H2