3-but-3-ynylsulfanyl-5-phenyl-1,2,4-triazine

Systemtic Name: 3-but-3-ynylsulfanyl-5-phenyl-1,2,4-triazine Openeye Name: 3-but-3-ynylsulfanyl-5-phenyl-1,2,4-triazine CAS Name: 3-(but-3-ynylthio)-5-phenyl-1,2,4-triazine IUPAC Name: 3-but-3-ynylsulfanyl-5-phenyl-1,2,4-triazine Traditional Name: 3-(but-3-ynylthio)-5-phenyl-1,2,4-triazine Formula: C13H11N3S MolecularWeight: 241.31154

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCSC1=NC(=CN=N1)C2=CC=CC=C2

Isomeric SMILES

C#CCCSC1=NC(=CN=N1)C2=CC=CC=C2

InChI

InChI=1S/C13H11N3S/c1-2-3-9-17-13-15-12(10-14-16-13)11-7-5-4-6-8-11/h1,4-8,10H,3,9H2