N-(azepan-1-ylcarbamoyl)-5-nitro-thiophene-3-carboxamide

Systemtic Name: N-(azepan-1-ylcarbamoyl)-5-nitro-thiophene-3-carboxamide Openeye Name: N-(azepan-1-ylcarbamoyl)-5-nitro-thiophene-3-carboxamide CAS Name: N-[(1-azepanylamino)-oxomethyl]-5-nitro-3-thiophenecarboxamide IUPAC Name: N-(azepan-1-ylcarbamoyl)-5-nitrothiophene-3-carboxamide Traditional Name: N-(azepan-1-ylcarbamoyl)-5-nitro-thiophene-3-carboxamide Formula: C12H16N4O4S MolecularWeight: 312.34484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)NC(=O)NC(=O)C2=CSC(=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)NC(=O)NC(=O)C2=CSC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O4S/c17-11(9-7-10(16(19)20)21-8-9)13-12(18)14-15-5-3-1-2-4-6-15/h7-8H,1-6H2,(H2,13,14,17,18)