N-ethyl-5-nitro-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-ethyl-5-nitro-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-1-benzothiophene-2-carboxamide Openeye Name: N-ethyl-N-[2-(isopropylamino)-2-oxo-ethyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-ethyl-5-nitro-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-ethyl-5-nitro-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1-benzothiophene-2-carboxamide Traditional Name: N-ethyl-N-[2-(isopropylamino)-2-keto-ethyl]-5-nitro-benzothiophene-2-carboxamide Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O4S/c1-4-18(9-15(20)17-10(2)3)16(21)14-8-11-7-12(19(22)23)5-6-13(11)24-14/h5-8,10H,4,9H2,1-3H3,(H,17,20)