2-(4-nitrophenyl)-1,3-benzothiazole-6-carboximidamide hydrochloride

Systemtic Name: 2-(4-nitrophenyl)-1,3-benzothiazole-6-carboximidamide hydrochloride Openeye Name: 2-(4-nitrophenyl)-1,3-benzothiazole-6-carboxamidine hydrochloride CAS Name: 2-(4-nitrophenyl)-1,3-benzothiazole-6-carboximidamide hydrochloride IUPAC Name: 2-(4-nitrophenyl)-1,3-benzothiazole-6-carboximidamide hydrochloride Traditional Name: 2-(4-nitrophenyl)-1,3-benzothiazole-6-carboxamidine hydrochloride Formula: C14H11ClN4O2S MolecularWeight: 334.78074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(S2)C=C(C=C3)C(=N)N)[N+](=O)[O-].Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(S2)C=C(C=C3)C(=N)N)[N+](=O)[O-].Cl

InChI

InChI=1S/C14H10N4O2S.ClH/c15-13(16)9-3-6-11-12(7-9)21-14(17-11)8-1-4-10(5-2-8)18(19)20;/h1-7H,(H3,15,16);1H