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

Systemtic Name: (4-cyclopropyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(2,4-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: (4-cyclopropyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-[(2,4-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: (4-cyclopropyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(2,4-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: (4-cyclopropyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(2,4-dimethoxyphenyl)methyl]-methylazanium Traditional Name: (4-cyclopropyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-(2,4-dimethoxybenzyl)-methyl-ammonium Formula: C17H25N4O2S+ MolecularWeight: 349.471

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)N1C2CC2)C[NH+](C)CC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC1=NN(C(=S)N1C2CC2)C[NH+](C)CC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C17H24N4O2S/c1-12-18-20(17(24)21(12)14-6-7-14)11-19(2)10-13-5-8-15(22-3)9-16(13)23-4/h5,8-9,14H,6-7,10-11H2,1-4H3/p+1