1-(4-methoxyphenyl)-N-(3-prop-2-ynylsulfanyl-1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-(4-methoxyphenyl)-N-(3-prop-2-ynylsulfanyl-1,2,4-triazol-4-yl)methanimine Openeye Name: 1-(4-methoxyphenyl)-N-(3-prop-2-ynylsulfanyl-1,2,4-triazol-4-yl)methanimine CAS Name: 1-(4-methoxyphenyl)-N-[3-(prop-2-ynylthio)-1,2,4-triazol-4-yl]methanimine IUPAC Name: 1-(4-methoxyphenyl)-N-(3-prop-2-ynylsulfanyl-1,2,4-triazol-4-yl)methanimine Traditional Name: (E)-p-anisylidene-[3-(propargylthio)-1,2,4-triazol-4-yl]amine Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=NN2C=NN=C2SCC#C

Isomeric SMILES

COC1=CC=C(C=C1)/C=N/N2C=NN=C2SCC#C

InChI

InChI=1S/C13H12N4OS/c1-3-8-19-13-16-14-10-17(13)15-9-11-4-6-12(18-2)7-5-11/h1,4-7,9-10H,8H2,2H3/b15-9+