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

Systemtic Name: 3-pent-4-ynylsulfanyl-5-phenyl-1,2,4-triazine Openeye Name: 3-pent-4-ynylsulfanyl-5-phenyl-1,2,4-triazine CAS Name: 3-(pent-4-ynylthio)-5-phenyl-1,2,4-triazine IUPAC Name: 3-pent-4-ynylsulfanyl-5-phenyl-1,2,4-triazine Traditional Name: 3-(pent-4-ynylthio)-5-phenyl-1,2,4-triazine Formula: C14H13N3S MolecularWeight: 255.33812

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCSC1=NC(=CN=N1)C2=CC=CC=C2

Isomeric SMILES

C#CCCCSC1=NC(=CN=N1)C2=CC=CC=C2

InChI

InChI=1S/C14H13N3S/c1-2-3-7-10-18-14-16-13(11-15-17-14)12-8-5-4-6-9-12/h1,4-6,8-9,11H,3,7,10H2