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

Systemtic Name: (4-cyclopropyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(3,4-dichlorophenyl)methyl]-methyl-azanium Openeye Name: [4-cyclopropyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-[(3,4-dichlorophenyl)methyl]-methyl-ammonium CAS Name: [4-cyclopropyl-3-(3-pyridinyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-[(3,4-dichlorophenyl)methyl]-methylammonium IUPAC Name: (4-cyclopropyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-[(3,4-dichlorophenyl)methyl]-methylazanium Traditional Name: [4-cyclopropyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-(3,4-dichlorobenzyl)-methyl-ammonium Formula: C19H20Cl2N5S+ MolecularWeight: 421.3666

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=C(C=C1)Cl)Cl)CN2C(=S)N(C(=N2)C3=CN=CC=C3)C4CC4

Isomeric SMILES

C[NH+](CC1=CC(=C(C=C1)Cl)Cl)CN2C(=S)N(C(=N2)C3=CN=CC=C3)C4CC4

InChI

InChI=1S/C19H19Cl2N5S/c1-24(11-13-4-7-16(20)17(21)9-13)12-25-19(27)26(15-5-6-15)18(23-25)14-3-2-8-22-10-14/h2-4,7-10,15H,5-6,11-12H2,1H3/p+1