[5-(5-chloranyl-2-methoxy-phenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [5-(5-chloranyl-2-methoxy-phenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [5-(5-chloro-2-methoxy-phenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl-methyl-(3-thienylmethyl)ammonium CAS Name: [5-(5-chloro-2-methoxyphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [5-(5-chloro-2-methoxyphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [5-(5-chloro-2-methoxy-phenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl-methyl-(3-thenyl)ammonium Formula: C16H18ClN4OS2+ MolecularWeight: 381.92332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClN4OS2/c1-20(8-11-5-6-24-9-11)10-21-16(23)18-15(19-21)13-7-12(17)3-4-14(13)22-2/h3-7,9H,8,10H2,1-2H3,(H,18,19,23)/p+1