N-[3-[(4-aminocarbonylphenyl)amino]-3-oxidanylidene-propyl]-N-ethyl-4-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[3-[(4-aminocarbonylphenyl)amino]-3-oxidanylidene-propyl]-N-ethyl-4-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[3-(4-carbamoylanilino)-3-oxo-propyl]-N-ethyl-4-fluoro-benzothiophene-2-carboxamide CAS Name: N-[3-(4-carbamoylanilino)-3-oxopropyl]-N-ethyl-4-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-[3-(4-carbamoylanilino)-3-oxopropyl]-N-ethyl-4-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-[3-(4-carbamoylanilino)-3-keto-propyl]-N-ethyl-4-fluoro-benzothiophene-2-carboxamide Formula: C21H20FN3O3S MolecularWeight: 413.465203

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC(=O)NC1=CC=C(C=C1)C(=O)N)C(=O)C2=CC3=C(C=CC=C3S2)F

Isomeric SMILES

CCN(CCC(=O)NC1=CC=C(C=C1)C(=O)N)C(=O)C2=CC3=C(C=CC=C3S2)F

InChI

InChI=1S/C21H20FN3O3S/c1-2-25(21(28)18-12-15-16(22)4-3-5-17(15)29-18)11-10-19(26)24-14-8-6-13(7-9-14)20(23)27/h3-9,12H,2,10-11H2,1H3,(H2,23,27)(H,24,26)