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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[[5-(cyclopropylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[[5-(cyclopropylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[[5-(cyclopropylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[[5-(cyclopropylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[[5-(cyclopropylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]-methyl-ammonium Formula: C15H18N5S3+ MolecularWeight: 364.53192

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CN3C(=S)SC(=N3)NC4CC4

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CN3C(=S)SC(=N3)NC4CC4

InChI

InChI=1S/C15H17N5S3/c1-19(8-13-17-11-4-2-3-5-12(11)22-13)9-20-15(21)23-14(18-20)16-10-6-7-10/h2-5,10H,6-9H2,1H3,(H,16,18)/p+1