cyclopentyl-cyclopropyl-[[3-methyl-4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]azanium

Systemtic Name: cyclopentyl-cyclopropyl-[[3-methyl-4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]azanium Openeye Name: cyclopentyl-cyclopropyl-[[3-methyl-4-(o-tolyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium CAS Name: cyclopentyl-cyclopropyl-[[3-methyl-4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]ammonium IUPAC Name: cyclopentyl-cyclopropyl-[[3-methyl-4-(2-methylphenyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]azanium Traditional Name: cyclopentyl-cyclopropyl-[[3-methyl-4-(o-tolyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium Formula: C19H27N4S+ MolecularWeight: 343.50948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN(C2=S)C[NH+](C3CCCC3)C4CC4)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN(C2=S)C[NH+](C3CCCC3)C4CC4)C

InChI

InChI=1S/C19H26N4S/c1-14-7-3-6-10-18(14)23-15(2)20-22(19(23)24)13-21(17-11-12-17)16-8-4-5-9-16/h3,6-7,10,16-17H,4-5,8-9,11-13H2,1-2H3/p+1