6-methylsulfanyl-N-(3-nitrophenyl)-1,3-benzothiazol-2-amine

Systemtic Name: 6-methylsulfanyl-N-(3-nitrophenyl)-1,3-benzothiazol-2-amine Openeye Name: 6-methylsulfanyl-N-(3-nitrophenyl)-1,3-benzothiazol-2-amine CAS Name: 6-(methylthio)-N-(3-nitrophenyl)-1,3-benzothiazol-2-amine IUPAC Name: 6-methylsulfanyl-N-(3-nitrophenyl)-1,3-benzothiazol-2-amine Traditional Name: [6-(methylthio)-1,3-benzothiazol-2-yl]-(3-nitrophenyl)amine Formula: C14H11N3O2S2 MolecularWeight: 317.38604

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N=C(S2)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC2=C(C=C1)N=C(S2)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O2S2/c1-20-11-5-6-12-13(8-11)21-14(16-12)15-9-3-2-4-10(7-9)17(18)19/h2-8H,1H3,(H,15,16)