(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl-prop-2-enyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: (5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl-prop-2-enyl-(thiophen-2-ylmethyl)azanium Openeye Name: allyl-[(5-phenyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]-(2-thienylmethyl)ammonium CAS Name: (5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl-prop-2-enyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: (5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl-prop-2-enyl-(thiophen-2-ylmethyl)azanium Traditional Name: allyl-[(5-phenyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]-(2-thenyl)ammonium Formula: C17H19N4S2+ MolecularWeight: 343.48956

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC1=CC=CS1)CN2C(=S)N=C(N2)C3=CC=CC=C3

Isomeric SMILES

C=CC[NH+](CC1=CC=CS1)CN2C(=S)N=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C17H18N4S2/c1-2-10-20(12-15-9-6-11-23-15)13-21-17(22)18-16(19-21)14-7-4-3-5-8-14/h2-9,11H,1,10,12-13H2,(H,18,19,22)/p+1