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

Systemtic Name: methyl-[(3-phenyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-(thiophen-3-ylmethyl)azanium Openeye Name: (4-allyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-(3-thienylmethyl)ammonium CAS Name: methyl-[(3-phenyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-(3-thiophenylmethyl)ammonium IUPAC Name: methyl-[(3-phenyl-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-(thiophen-3-ylmethyl)azanium Traditional Name: (4-allyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-(3-thenyl)ammonium Formula: C18H21N4S2+ MolecularWeight: 357.51614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N4S2/c1-3-10-21-17(16-7-5-4-6-8-16)19-22(18(21)23)14-20(2)12-15-9-11-24-13-15/h3-9,11,13H,1,10,12,14H2,2H3/p+1