3-phenethylsulfanyl-5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazole

Systemtic Name: 3-phenethylsulfanyl-5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazole Openeye Name: 3-phenethylsulfanyl-5-[(E)-2-(2-thienyl)vinyl]-1H-1,2,4-triazole CAS Name: 3-(phenethylthio)-5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazole IUPAC Name: 3-phenethylsulfanyl-5-[(E)-2-thiophen-2-ylethenyl]-1H-1,2,4-triazole Traditional Name: 3-(phenethylthio)-5-[(E)-2-(2-thienyl)vinyl]-1H-1,2,4-triazole Formula: C16H15N3S2 MolecularWeight: 313.4404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NNC(=N2)C=CC3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NNC(=N2)/C=C/C3=CC=CS3

InChI

InChI=1S/C16H15N3S2/c1-2-5-13(6-3-1)10-12-21-16-17-15(18-19-16)9-8-14-7-4-11-20-14/h1-9,11H,10,12H2,(H,17,18,19)/b9-8+