N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-5-nitro-benzothiophene-2-carboxamide Formula: C17H11N3O3S3 MolecularWeight: 401.48254

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H11N3O3S3/c1-24-17-19-12-4-2-10(8-14(12)26-17)18-16(21)15-7-9-6-11(20(22)23)3-5-13(9)25-15/h2-8H,1H3,(H,18,21)