1-phenyl-4-prop-2-ynylsulfanyl-phthalazine

Systemtic Name: 1-phenyl-4-prop-2-ynylsulfanyl-phthalazine Openeye Name: 1-phenyl-4-prop-2-ynylsulfanyl-phthalazine CAS Name: 1-phenyl-4-(prop-2-ynylthio)phthalazine IUPAC Name: 1-phenyl-4-prop-2-ynylsulfanylphthalazine Traditional Name: 1-phenyl-4-(propargylthio)phthalazine Formula: C17H12N2S MolecularWeight: 276.35558

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Descriptors Computed from Structure

Canonical SMILES:

C#CCSC1=NN=C(C2=CC=CC=C21)C3=CC=CC=C3

Isomeric SMILES

C#CCSC1=NN=C(C2=CC=CC=C21)C3=CC=CC=C3

InChI

InChI=1S/C17H12N2S/c1-2-12-20-17-15-11-7-6-10-14(15)16(18-19-17)13-8-4-3-5-9-13/h1,3-11H,12H2