3-[(6-chloranylpyridin-3-yl)methyl-cyclopropyl-amino]-2H-furan-5-one; (3,5-dimethyl-4-methylsulfanyl-phenyl) N-methylcarbamate

Systemtic Name: 3-[(6-chloranylpyridin-3-yl)methyl-cyclopropyl-amino]-2H-furan-5-one; (3,5-dimethyl-4-methylsulfanyl-phenyl) N-methylcarbamate Openeye Name: 3-[(6-chloro-3-pyridyl)methyl-cyclopropyl-amino]-2H-furan-5-one; (3,5-dimethyl-4-methylsulfanyl-phenyl) N-methylcarbamate CAS Name: 3-[(6-chloro-3-pyridinyl)methyl-cyclopropylamino]-2H-furan-5-one; N-methylcarbamic acid [3,5-dimethyl-4-(methylthio)phenyl] ester IUPAC Name: 3-[(6-chloropyridin-3-yl)methyl-cyclopropylamino]-2H-furan-5-one; (3,5-dimethyl-4-methylsulfanylphenyl) N-methylcarbamate Traditional Name: 3-[(6-chloro-3-pyridyl)methyl-cyclopropyl-amino]-2H-furan-5-one; N-methylcarbamic acid [3,5-dimethyl-4-(methylthio)phenyl] ester Formula: C24H28ClN3O4S MolecularWeight: 490.01482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1SC)C)OC(=O)NC.C1CC1N(CC2=CN=C(C=C2)Cl)C3=CC(=O)OC3

Isomeric SMILES

CC1=CC(=CC(=C1SC)C)OC(=O)NC.C1CC1N(CC2=CN=C(C=C2)Cl)C3=CC(=O)OC3

InChI

InChI=1S/C13H13ClN2O2.C11H15NO2S/c14-12-4-1-9(6-15-12)7-16(10-2-3-10)11-5-13(17)18-8-11;1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h1,4-6,10H,2-3,7-8H2;5-6H,1-4H3,(H,12,13)