(2-chlorophenyl) 2-[1-(furan-2-ylmethylamino)-1-oxidanylidene-butan-2-yl]sulfanylpyridine-3-carboxylate

Systemtic Name: (2-chlorophenyl) 2-[1-(furan-2-ylmethylamino)-1-oxidanylidene-butan-2-yl]sulfanylpyridine-3-carboxylate Openeye Name: (2-chlorophenyl) 2-[1-(2-furylmethylcarbamoyl)propylsulfanyl]pyridine-3-carboxylate CAS Name: 2-[[1-(2-furanylmethylamino)-1-oxobutan-2-yl]thio]-3-pyridinecarboxylic acid (2-chlorophenyl) ester IUPAC Name: (2-chlorophenyl) 2-[1-(furan-2-ylmethylamino)-1-oxobutan-2-yl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[1-(2-furfurylcarbamoyl)propylthio]nicotinic acid (2-chlorophenyl) ester Formula: C21H19ClN2O4S MolecularWeight: 430.90456

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CO1)SC2=C(C=CC=N2)C(=O)OC3=CC=CC=C3Cl

Isomeric SMILES

CCC(C(=O)NCC1=CC=CO1)SC2=C(C=CC=N2)C(=O)OC3=CC=CC=C3Cl

InChI

InChI=1S/C21H19ClN2O4S/c1-2-18(19(25)24-13-14-7-6-12-27-14)29-20-15(8-5-11-23-20)21(26)28-17-10-4-3-9-16(17)22/h3-12,18H,2,13H2,1H3,(H,24,25)