cyclopropyl-[[4-(3-fluorophenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]methyl]-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: cyclopropyl-[[4-(3-fluorophenyl)-5-sulfanylidene-1,2,3,4-tetrazol-1-yl]methyl]-[(4-methoxyphenyl)methyl]azanium Openeye Name: cyclopropyl-[[4-(3-fluorophenyl)-5-thioxo-tetrazol-1-yl]methyl]-[(4-methoxyphenyl)methyl]ammonium CAS Name: cyclopropyl-[[4-(3-fluorophenyl)-5-sulfanylidene-1-tetrazolyl]methyl]-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: cyclopropyl-[[4-(3-fluorophenyl)-5-sulfanylidenetetrazol-1-yl]methyl]-[(4-methoxyphenyl)methyl]azanium Traditional Name: cyclopropyl-[[4-(3-fluorophenyl)-5-thioxo-tetrazol-1-yl]methyl]-p-anisyl-ammonium Formula: C19H21FN5OS+ MolecularWeight: 386.466343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20FN5OS/c1-26-18-9-5-14(6-10-18)12-23(16-7-8-16)13-24-19(27)25(22-21-24)17-4-2-3-15(20)11-17/h2-6,9-11,16H,7-8,12-13H2,1H3/p+1