[5-[(4-methoxyphenyl)amino]-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [5-[(4-methoxyphenyl)amino]-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-(2-phenoxyethyl)azanium Openeye Name: [5-(4-methoxyanilino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl-methyl-(2-phenoxyethyl)ammonium CAS Name: [5-(4-methoxyanilino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [5-(4-methoxyanilino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-(2-phenoxyethyl)azanium Traditional Name: methyl-[[5-(p-anisidino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]-(2-phenoxyethyl)ammonium Formula: C19H23N4O2S2+ MolecularWeight: 403.54152

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1)CN2C(=S)SC(=N2)NC3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1)CN2C(=S)SC(=N2)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H22N4O2S2/c1-22(12-13-25-17-6-4-3-5-7-17)14-23-19(26)27-18(21-23)20-15-8-10-16(24-2)11-9-15/h3-11H,12-14H2,1-2H3,(H,20,21)/p+1