(4-methoxycarbonylphenyl)methyl-methyl-[(4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium

Systemtic Name: (4-methoxycarbonylphenyl)methyl-methyl-[(4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: (4-methoxycarbonylphenyl)methyl-methyl-[(4-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium CAS Name: (4-methoxycarbonylphenyl)methyl-methyl-[(4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: (4-methoxycarbonylphenyl)methyl-methyl-[(4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: (4-carbomethoxybenzyl)-methyl-[(4-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium Formula: C19H21N4O2S+ MolecularWeight: 369.46064

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)C(=O)OC)CN2C(=S)N(C=N2)C3=CC=CC=C3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)C(=O)OC)CN2C(=S)N(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C19H20N4O2S/c1-21(12-15-8-10-16(11-9-15)18(24)25-2)14-23-19(26)22(13-20-23)17-6-4-3-5-7-17/h3-11,13H,12,14H2,1-2H3/p+1