1,3-benzothiazol-2-ylmethyl-methyl-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-methyl-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-methyl-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium Formula: C16H16N5S3+ MolecularWeight: 374.52674

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CN3C(=S)N=C(N3)C4=CC=CS4

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CN3C(=S)N=C(N3)C4=CC=CS4

InChI

InChI=1S/C16H15N5S3/c1-20(9-14-17-11-5-2-3-6-12(11)24-14)10-21-16(22)18-15(19-21)13-7-4-8-23-13/h2-8H,9-10H2,1H3,(H,18,19,22)/p+1