1-methyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)phthalazine

Systemtic Name: 1-methyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)phthalazine Openeye Name: 1-methyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)phthalazine CAS Name: 1-methyl-4-(1H-1,2,4-triazol-5-ylthio)phthalazine IUPAC Name: 1-methyl-4-(1H-1,2,4-triazol-5-ylsulfanyl)phthalazine Traditional Name: 1-methyl-4-(1H-1,2,4-triazol-5-ylthio)phthalazine Formula: C11H9N5S MolecularWeight: 243.28766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=CC=CC=C12)SC3=NC=NN3

Isomeric SMILES

CC1=NN=C(C2=CC=CC=C12)SC3=NC=NN3

InChI

InChI=1S/C11H9N5S/c1-7-8-4-2-3-5-9(8)10(15-14-7)17-11-12-6-13-16-11/h2-6H,1H3,(H,12,13,16)