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

Systemtic Name: N-(3-acetamido-4-methoxy-phenyl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(3-acetamido-4-methoxy-phenyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(3-acetamido-4-methoxyphenyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(3-acetamido-4-methoxyphenyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(3-acetamido-4-methoxy-phenyl)-5-nitro-benzothiophene-2-carboxamide Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N3O5S/c1-10(22)19-14-9-12(3-5-15(14)26-2)20-18(23)17-8-11-7-13(21(24)25)4-6-16(11)27-17/h3-9H,1-2H3,(H,19,22)(H,20,23)