1,3-benzothiazol-2-ylmethyl-[[5-(4-ethoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[[5-(4-ethoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[[5-(4-ethoxyphenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[[5-(4-ethoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[[5-(4-ethoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(5-p-phenetyl-2-thioxo-1,3,4-oxadiazol-3-yl)methyl]ammonium Formula: C20H21N4O2S2+ MolecularWeight: 413.53634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=S)O2)C[NH+](C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=S)O2)C[NH+](C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20N4O2S2/c1-3-25-15-10-8-14(9-11-15)19-22-24(20(27)26-19)13-23(2)12-18-21-16-6-4-5-7-17(16)28-18/h4-11H,3,12-13H2,1-2H3/p+1