[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[[3-(2-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-methyl-azanium

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[[3-(2-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-methyl-azanium Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl]-[[3-(2-methoxyphenyl)-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl]-methyl-ammonium CAS Name: [2-(cyclopropylamino)-2-oxoethyl]-[[3-(2-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-methylammonium IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl]-[[3-(2-methoxyphenyl)-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-methylazanium Traditional Name: [2-(cyclopropylamino)-2-keto-ethyl]-[[3-(2-methoxyphenyl)-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl]-methyl-ammonium Formula: C17H24N5O2S+ MolecularWeight: 362.46976

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+](C)CC(=O)NC2CC2)C3=CC=CC=C3OC

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+](C)CC(=O)NC2CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C17H23N5O2S/c1-20(10-15(23)18-12-8-9-12)11-22-17(25)21(2)16(19-22)13-6-4-5-7-14(13)24-3/h4-7,12H,8-11H2,1-3H3,(H,18,23)/p+1