N-butan-2-yl-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-butan-2-yl-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: 5-nitro-N-sec-butyl-benzothiophene-2-carboxamide CAS Name: N-butan-2-yl-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-butan-2-yl-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: 5-nitro-N-sec-butyl-benzothiophene-2-carboxamide Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O3S/c1-3-8(2)14-13(16)12-7-9-6-10(15(17)18)4-5-11(9)19-12/h4-8H,3H2,1-2H3,(H,14,16)