1,3-benzothiazol-2-ylmethyl-methyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-methyl-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-methyl-ammonium Formula: C16H15N4OS2+ MolecularWeight: 343.4465

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC(=O)C2=C(N1)C=CS2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C[NH+](CC1=NC(=O)C2=C(N1)C=CS2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C16H14N4OS2/c1-20(9-14-18-10-4-2-3-5-12(10)23-14)8-13-17-11-6-7-22-15(11)16(21)19-13/h2-7H,8-9H2,1H3,(H,17,19,21)/p+1