2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-quinolin-5-yl-benzamide

Systemtic Name: 2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-quinolin-5-yl-benzamide Openeye Name: 2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-N-(5-quinolyl)benzamide CAS Name: 2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-N-(5-quinolinyl)benzamide IUPAC Name: 2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-N-quinolin-5-ylbenzamide Traditional Name: 2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-N-(5-quinolyl)benzamide Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=CC3=C2C=CC=N3)SCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=CC3=C2C=CC=N3)SCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C23H19N3O3S/c27-22(25-14-16-6-5-13-29-16)15-30-21-11-2-1-7-18(21)23(28)26-20-10-3-9-19-17(20)8-4-12-24-19/h1-13H,14-15H2,(H,25,27)(H,26,28)