2-[(2-chloranyl-6-nitro-phenyl)methylsulfanyl]-1,3-benzothiazol-6-amine

Systemtic Name: 2-[(2-chloranyl-6-nitro-phenyl)methylsulfanyl]-1,3-benzothiazol-6-amine Openeye Name: 2-[(2-chloro-6-nitro-phenyl)methylsulfanyl]-1,3-benzothiazol-6-amine CAS Name: 2-[(2-chloro-6-nitrophenyl)methylthio]-1,3-benzothiazol-6-amine IUPAC Name: 2-[(2-chloro-6-nitrophenyl)methylsulfanyl]-1,3-benzothiazol-6-amine Traditional Name: [2-[(2-chloro-6-nitro-benzyl)thio]-1,3-benzothiazol-6-yl]amine Formula: C14H10ClN3O2S2 MolecularWeight: 351.8311

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSC2=NC3=C(S2)C=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSC2=NC3=C(S2)C=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C14H10ClN3O2S2/c15-10-2-1-3-12(18(19)20)9(10)7-21-14-17-11-5-4-8(16)6-13(11)22-14/h1-6H,7,16H2