2-(2-methylsulfanyl-4-prop-2-ynoxy-phenyl)-1H-imidazo[4,5-d]pyridazine

Systemtic Name: 2-(2-methylsulfanyl-4-prop-2-ynoxy-phenyl)-1H-imidazo[4,5-d]pyridazine Openeye Name: 2-(2-methylsulfanyl-4-prop-2-ynoxy-phenyl)-1H-imidazo[4,5-d]pyridazine CAS Name: 2-[2-(methylthio)-4-prop-2-ynoxyphenyl]-1H-imidazo[4,5-d]pyridazine IUPAC Name: 2-(2-methylsulfanyl-4-prop-2-ynoxyphenyl)-1H-imidazo[4,5-d]pyridazine Traditional Name: 2-[2-(methylthio)-4-propargyloxy-phenyl]-1H-imidazo[4,5-d]pyridazine Formula: C15H12N4OS MolecularWeight: 296.34698

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC(=C1)OCC#C)C2=NC3=CN=NC=C3N2

Isomeric SMILES

CSC1=C(C=CC(=C1)OCC#C)C2=NC3=CN=NC=C3N2

InChI

InChI=1S/C15H12N4OS/c1-3-6-20-10-4-5-11(14(7-10)21-2)15-18-12-8-16-17-9-13(12)19-15/h1,4-5,7-9H,6H2,2H3,(H,18,19)