2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]propanamide

Systemtic Name: 2-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]propanamide Openeye Name: 2-(5-chloro-2-methyl-N-methylsulfonyl-anilino)-N-[2-(2-furylmethylsulfanyl)ethyl]propanamide CAS Name: 2-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[2-(2-furanylmethylthio)ethyl]propanamide IUPAC Name: 2-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[2-(furan-2-ylmethylsulfanyl)ethyl]propanamide Traditional Name: 2-(5-chloro-N-mesyl-2-methyl-anilino)-N-[2-(2-furfurylthio)ethyl]propionamide Formula: C18H23ClN2O4S2 MolecularWeight: 430.96922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(C(C)C(=O)NCCSCC2=CC=CO2)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(C(C)C(=O)NCCSCC2=CC=CO2)S(=O)(=O)C

InChI

InChI=1S/C18H23ClN2O4S2/c1-13-6-7-15(19)11-17(13)21(27(3,23)24)14(2)18(22)20-8-10-26-12-16-5-4-9-25-16/h4-7,9,11,14H,8,10,12H2,1-3H3,(H,20,22)