7-[(4-chlorophenyl)methylsulfanyl]-3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazine

Systemtic Name: 7-[(4-chlorophenyl)methylsulfanyl]-3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazine Openeye Name: 7-[(4-chlorophenyl)methylsulfanyl]-3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazine CAS Name: 7-[(4-chlorophenyl)methylthio]-3,4-dimethyl-2-phenylpyrazolo[3,4-d]pyridazine IUPAC Name: 7-[(4-chlorophenyl)methylsulfanyl]-3,4-dimethyl-2-phenylpyrazolo[3,4-d]pyridazine Traditional Name: 7-[(4-chlorobenzyl)thio]-3,4-dimethyl-2-phenyl-pyrazolo[3,4-d]pyridazine Formula: C20H17ClN4S MolecularWeight: 380.89378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN=C(C2=NN1C3=CC=CC=C3)SCC4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=C2C(=NN=C(C2=NN1C3=CC=CC=C3)SCC4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C20H17ClN4S/c1-13-18-14(2)25(17-6-4-3-5-7-17)24-19(18)20(23-22-13)26-12-15-8-10-16(21)11-9-15/h3-11H,12H2,1-2H3