3-butylsulfanyl-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole

Systemtic Name: 3-butylsulfanyl-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole Openeye Name: 3-butylsulfanyl-5-[(E)-styryl]-1H-1,2,4-triazole CAS Name: 3-(butylthio)-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole IUPAC Name: 3-butylsulfanyl-5-[(E)-2-phenylethenyl]-1H-1,2,4-triazole Traditional Name: 3-(butylthio)-5-[(E)-styryl]-1H-1,2,4-triazole Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NNC(=N1)C=CC2=CC=CC=C2

Isomeric SMILES

CCCCSC1=NNC(=N1)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C14H17N3S/c1-2-3-11-18-14-15-13(16-17-14)10-9-12-7-5-4-6-8-12/h4-10H,2-3,11H2,1H3,(H,15,16,17)/b10-9+