1,3-benzothiazol-2-ylmethyl-[2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[2-[(2-chloranylpyridin-3-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[2-[(2-chloro-3-pyridyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[2-[(2-chloro-3-pyridinyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-[(2-chloro-3-pyridyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C16H16ClN4OS+ MolecularWeight: 347.84244

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=C(N=CC=C3)Cl

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3=C(N=CC=C3)Cl

InChI

InChI=1S/C16H15ClN4OS/c1-21(9-14(22)19-12-6-4-8-18-16(12)17)10-15-20-11-5-2-3-7-13(11)23-15/h2-8H,9-10H2,1H3,(H,19,22)/p+1