N-[5-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]-2-fluoranyl-phenyl]-2-methyl-furan-3-carboxamide

Systemtic Name: N-[5-[[4-(1,3-dithian-2-yl)phenyl]carbonylamino]-2-fluoranyl-phenyl]-2-methyl-furan-3-carboxamide Openeye Name: N-[5-[[4-(1,3-dithian-2-yl)benzoyl]amino]-2-fluoro-phenyl]-2-methyl-furan-3-carboxamide CAS Name: N-[5-[[[4-(1,3-dithian-2-yl)phenyl]-oxomethyl]amino]-2-fluorophenyl]-2-methyl-3-furancarboxamide IUPAC Name: N-[5-[[4-(1,3-dithian-2-yl)benzoyl]amino]-2-fluorophenyl]-2-methylfuran-3-carboxamide Traditional Name: N-[5-[[4-(1,3-dithian-2-yl)benzoyl]amino]-2-fluoro-phenyl]-2-methyl-3-furamide Formula: C23H21FN2O3S2 MolecularWeight: 456.552843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)NC2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)C4SCCCS4)F

Isomeric SMILES

CC1=C(C=CO1)C(=O)NC2=C(C=CC(=C2)NC(=O)C3=CC=C(C=C3)C4SCCCS4)F

InChI

InChI=1S/C23H21FN2O3S2/c1-14-18(9-10-29-14)22(28)26-20-13-17(7-8-19(20)24)25-21(27)15-3-5-16(6-4-15)23-30-11-2-12-31-23/h3-10,13,23H,2,11-12H2,1H3,(H,25,27)(H,26,28)