N-(2,6-diethylphenyl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2,6-diethylphenyl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(2,6-diethylphenyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(2,6-diethylphenyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2,6-diethylphenyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(2,6-diethylphenyl)-5-nitro-benzothiophene-2-carboxamide Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O3S/c1-3-12-6-5-7-13(4-2)18(12)20-19(22)17-11-14-10-15(21(23)24)8-9-16(14)25-17/h5-11H,3-4H2,1-2H3,(H,20,22)