N-(4-acetamido-3-chloranyl-phenyl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(4-acetamido-3-chlorophenyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-5-nitro-benzothiophene-2-carboxamide Formula: C17H12ClN3O4S MolecularWeight: 389.81288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H12ClN3O4S/c1-9(22)19-14-4-2-11(8-13(14)18)20-17(23)16-7-10-6-12(21(24)25)3-5-15(10)26-16/h2-8H,1H3,(H,19,22)(H,20,23)