2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(4-methyl-2-oxidanyl-phenyl)benzamide

Systemtic Name: 2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(4-methyl-2-oxidanyl-phenyl)benzamide Openeye Name: 2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-N-(2-hydroxy-4-methyl-phenyl)benzamide CAS Name: 2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-N-(2-hydroxy-4-methylphenyl)benzamide IUPAC Name: 2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-N-(2-hydroxy-4-methylphenyl)benzamide Traditional Name: 2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-N-(2-hydroxy-4-methyl-phenyl)benzamide Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)NCC3=CC=CO3)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC=CC=C2SCC(=O)NCC3=CC=CO3)O

InChI

InChI=1S/C21H20N2O4S/c1-14-8-9-17(18(24)11-14)23-21(26)16-6-2-3-7-19(16)28-13-20(25)22-12-15-5-4-10-27-15/h2-11,24H,12-13H2,1H3,(H,22,25)(H,23,26)