N-[3-(chloromethyl)-2H-benzotriazol-3-ium-5-yl]-N-methyl-1,3-benzothiazol-2-amine hydrochloride

Systemtic Name: N-[3-(chloromethyl)-2H-benzotriazol-3-ium-5-yl]-N-methyl-1,3-benzothiazol-2-amine hydrochloride Openeye Name: N-[3-(chloromethyl)-2H-benzotriazol-3-ium-5-yl]-N-methyl-1,3-benzothiazol-2-amine hydrochloride CAS Name: N-[3-(chloromethyl)-2H-benzotriazol-3-ium-5-yl]-N-methyl-1,3-benzothiazol-2-amine hydrochloride IUPAC Name: N-[3-(chloromethyl)-2H-benzotriazol-3-ium-5-yl]-N-methyl-1,3-benzothiazol-2-amine hydrochloride Traditional Name: 1,3-benzothiazol-2-yl-[3-(chloromethyl)-2H-benzotriazol-3-ium-5-yl]-methyl-amine hydrochloride Formula: C15H14Cl2N5S+ MolecularWeight: 367.27616

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC2=[N+](NN=C2C=C1)CCl)C3=NC4=CC=CC=C4S3.Cl

Isomeric SMILES

CN(C1=CC2=[N+](NN=C2C=C1)CCl)C3=NC4=CC=CC=C4S3.Cl

InChI

InChI=1S/C15H12ClN5S.ClH/c1-20(15-17-12-4-2-3-5-14(12)22-15)10-6-7-11-13(8-10)21(9-16)19-18-11;/h2-8H,9H2,1H3;1H/p+1