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

Systemtic Name: (4-methoxyphenyl)methyl-methyl-[(4-propyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: (4-methoxyphenyl)methyl-methyl-[[4-propyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium CAS Name: (4-methoxyphenyl)methyl-methyl-[(4-propyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: (4-methoxyphenyl)methyl-methyl-[(4-propyl-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: methyl-p-anisyl-[[4-propyl-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium Formula: C20H26N5OS+ MolecularWeight: 384.51834

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN(C1=S)C[NH+](C)CC2=CC=C(C=C2)OC)C3=CC=NC=C3

Isomeric SMILES

CCCN1C(=NN(C1=S)C[NH+](C)CC2=CC=C(C=C2)OC)C3=CC=NC=C3

InChI

InChI=1S/C20H25N5OS/c1-4-13-24-19(17-9-11-21-12-10-17)22-25(20(24)27)15-23(2)14-16-5-7-18(26-3)8-6-16/h5-12H,4,13-15H2,1-3H3/p+1