(4-ethoxy-3-methoxy-phenyl)methyl-methyl-[[5-(propylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]azanium

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)methyl-methyl-[[5-(propylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]azanium Openeye Name: (4-ethoxy-3-methoxy-phenyl)methyl-methyl-[[5-(propylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]ammonium CAS Name: (4-ethoxy-3-methoxyphenyl)methyl-methyl-[[5-(propylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]ammonium IUPAC Name: (4-ethoxy-3-methoxyphenyl)methyl-methyl-[[5-(propylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]azanium Traditional Name: (4-ethoxy-3-methoxy-benzyl)-methyl-[[5-(propylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]ammonium Formula: C17H27N4O2S2+ MolecularWeight: 383.55188

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NN(C(=S)S1)C[NH+](C)CC2=CC(=C(C=C2)OCC)OC

Isomeric SMILES

CCCNC1=NN(C(=S)S1)C[NH+](C)CC2=CC(=C(C=C2)OCC)OC

InChI

InChI=1S/C17H26N4O2S2/c1-5-9-18-16-19-21(17(24)25-16)12-20(3)11-13-7-8-14(23-6-2)15(10-13)22-4/h7-8,10H,5-6,9,11-12H2,1-4H3,(H,18,19)/p+1