[5-(3-ethoxypropylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-[(2-methylphenyl)methyl]azanium

Systemtic Name: [5-(3-ethoxypropylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-[(2-methylphenyl)methyl]azanium Openeye Name: [5-(3-ethoxypropylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl-methyl-(o-tolylmethyl)ammonium CAS Name: [5-(3-ethoxypropylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-[(2-methylphenyl)methyl]ammonium IUPAC Name: [5-(3-ethoxypropylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-[(2-methylphenyl)methyl]azanium Traditional Name: [5-(3-ethoxypropylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl-methyl-(2-methylbenzyl)ammonium Formula: C17H27N4OS2+ MolecularWeight: 367.55248

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC1=NN(C(=S)S1)C[NH+](C)CC2=CC=CC=C2C

Isomeric SMILES

CCOCCCNC1=NN(C(=S)S1)C[NH+](C)CC2=CC=CC=C2C

InChI

InChI=1S/C17H26N4OS2/c1-4-22-11-7-10-18-16-19-21(17(23)24-16)13-20(3)12-15-9-6-5-8-14(15)2/h5-6,8-9H,4,7,10-13H2,1-3H3,(H,18,19)/p+1