N-(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(3-carbamoyl-4,5-dimethyl-2-thienyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(3-carbamoyl-4,5-dimethyl-2-thiophenyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(3-carbamoyl-4,5-dimethyl-2-thienyl)-5-nitro-benzothiophene-2-carboxamide Formula: C16H13N3O4S2 MolecularWeight: 375.42212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C16H13N3O4S2/c1-7-8(2)24-16(13(7)14(17)20)18-15(21)12-6-9-5-10(19(22)23)3-4-11(9)25-12/h3-6H,1-2H3,(H2,17,20)(H,18,21)