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1-(isoquinolin-1-ylmethylsulfanyl)phthalazine

1-(isoquinolin-1-ylmethylsulfanyl)phthalazine

Systemtic Name:1-(isoquinolin-1-ylmethylsulfanyl)phthalazine
Openeye Name:1-(1-isoquinolylmethylsulfanyl)phthalazine
CAS Name:1-(1-isoquinolinylmethylthio)phthalazine
IUPAC Name:1-(isoquinolin-1-ylmethylsulfanyl)phthalazine
Traditional Name:1-(1-isoquinolylmethylthio)phthalazine
Formula: C18H13N3S
MolecularWeight: 303.38092
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2CSC3=NN=CC4=CC=CC=C43


Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2CSC3=NN=CC4=CC=CC=C43


InChI

InChI=1S/C18H13N3S/c1-3-7-15-13(5-1)9-10-19-17(15)12-22-18-16-8-4-2-6-14(16)11-20-21-18/h1-11H,12H2


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