N-[(3-fluoranyl-4-pentoxy-phenyl)carbamothioyl]furo[3,2-c]pyridine-2-carboxamide hydrochloride

Systemtic Name: N-[(3-fluoranyl-4-pentoxy-phenyl)carbamothioyl]furo[3,2-c]pyridine-2-carboxamide hydrochloride Openeye Name: N-[(3-fluoro-4-pentoxy-phenyl)carbamothioyl]furo[3,2-c]pyridine-2-carboxamide hydrochloride CAS Name: N-[(3-fluoro-4-pentoxyanilino)-sulfanylidenemethyl]-2-furo[3,2-c]pyridinecarboxamide hydrochloride IUPAC Name: N-[(3-fluoro-4-pentoxyphenyl)carbamothioyl]furo[3,2-c]pyridine-2-carboxamide hydrochloride Traditional Name: N-[(4-amoxy-3-fluoro-phenyl)thiocarbamoyl]furo[3,2-c]pyridine-2-carboxamide hydrochloride Formula: C20H21ClFN3O3S MolecularWeight: 437.915443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC3=C(O2)C=CN=C3)F.Cl

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC3=C(O2)C=CN=C3)F.Cl

InChI

InChI=1S/C20H20FN3O3S.ClH/c1-2-3-4-9-26-17-6-5-14(11-15(17)21)23-20(28)24-19(25)18-10-13-12-22-8-7-16(13)27-18;/h5-8,10-12H,2-4,9H2,1H3,(H2,23,24,25,28);1H