3,6-bis(chloranyl)-N-(2,3-dimethyl-6-nitro-phenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-(2,3-dimethyl-6-nitro-phenyl)-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-(2,3-dimethyl-6-nitro-phenyl)benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-(2,3-dimethyl-6-nitrophenyl)-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-(2,3-dimethyl-6-nitrophenyl)-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-(2,3-dimethyl-6-nitro-phenyl)benzothiophene-2-carboxamide Formula: C17H12Cl2N2O3S MolecularWeight: 395.25978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C17H12Cl2N2O3S/c1-8-3-6-12(21(23)24)15(9(8)2)20-17(22)16-14(19)11-5-4-10(18)7-13(11)25-16/h3-7H,1-2H3,(H,20,22)