3,4-dimethyl-2-(4-methylphenyl)-7-(2-piperidin-1-ylethylsulfanyl)pyrazolo[3,4-d]pyridazine

Systemtic Name: 3,4-dimethyl-2-(4-methylphenyl)-7-(2-piperidin-1-ylethylsulfanyl)pyrazolo[3,4-d]pyridazine Openeye Name: 3,4-dimethyl-7-[2-(1-piperidyl)ethylsulfanyl]-2-(p-tolyl)pyrazolo[3,4-d]pyridazine CAS Name: 3,4-dimethyl-2-(4-methylphenyl)-7-[2-(1-piperidinyl)ethylthio]pyrazolo[3,4-d]pyridazine IUPAC Name: 3,4-dimethyl-2-(4-methylphenyl)-7-(2-piperidin-1-ylethylsulfanyl)pyrazolo[3,4-d]pyridazine Traditional Name: 3,4-dimethyl-7-(2-piperidinoethylthio)-2-(p-tolyl)pyrazolo[3,4-d]pyridazine Formula: C21H27N5S MolecularWeight: 381.53758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C3C(=NN=C(C3=N2)SCCN4CCCCC4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C3C(=NN=C(C3=N2)SCCN4CCCCC4)C)C

InChI

InChI=1S/C21H27N5S/c1-15-7-9-18(10-8-15)26-17(3)19-16(2)22-23-21(20(19)24-26)27-14-13-25-11-5-4-6-12-25/h7-10H,4-6,11-14H2,1-3H3