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

Systemtic Name: (3,4-dimethoxyphenyl)methyl-[(4-ethyl-3-morpholin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methyl-azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-[(4-ethyl-3-morpholino-5-thioxo-1,2,4-triazol-1-yl)methyl]-methyl-ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-[[4-ethyl-3-(4-morpholinyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-methylammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-[(4-ethyl-3-morpholin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-methylazanium Traditional Name: (4-ethyl-3-morpholino-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-veratryl-ammonium Formula: C19H30N5O3S+ MolecularWeight: 408.5382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)C[NH+](C)CC2=CC(=C(C=C2)OC)OC)N3CCOCC3

Isomeric SMILES

CCN1C(=NN(C1=S)C[NH+](C)CC2=CC(=C(C=C2)OC)OC)N3CCOCC3

InChI

InChI=1S/C19H29N5O3S/c1-5-23-18(22-8-10-27-11-9-22)20-24(19(23)28)14-21(2)13-15-6-7-16(25-3)17(12-15)26-4/h6-7,12H,5,8-11,13-14H2,1-4H3/p+1