N-[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(4,5-dichloro-1,3-benzothiazol-2-yl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(4,5-dichloro-1,3-benzothiazol-2-yl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(4,5-dichloro-1,3-benzothiazol-2-yl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(4,5-dichloro-1,3-benzothiazol-2-yl)-5-nitro-benzothiophene-2-carboxamide Formula: C16H7Cl2N3O3S2 MolecularWeight: 424.28108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C=C(S2)C(=O)NC3=NC4=C(S3)C=CC(=C4Cl)Cl

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C=C(S2)C(=O)NC3=NC4=C(S3)C=CC(=C4Cl)Cl

InChI

InChI=1S/C16H7Cl2N3O3S2/c17-9-2-4-11-14(13(9)18)19-16(26-11)20-15(22)12-6-7-5-8(21(23)24)1-3-10(7)25-12/h1-6H,(H,19,20,22)