cyclopropyl-[(4-methoxyphenyl)methyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium

Systemtic Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium Openeye Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium CAS Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]ammonium IUPAC Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium Traditional Name: cyclopropyl-p-anisyl-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium Formula: C18H21N4OS2+ MolecularWeight: 373.51554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+](CN2C(=S)N=C(N2)C3=CC=CS3)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+](CN2C(=S)N=C(N2)C3=CC=CS3)C4CC4

InChI

InChI=1S/C18H20N4OS2/c1-23-15-8-4-13(5-9-15)11-21(14-6-7-14)12-22-18(24)19-17(20-22)16-3-2-10-25-16/h2-5,8-10,14H,6-7,11-12H2,1H3,(H,19,20,24)/p+1