N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-methyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-methyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-methyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[2-[(4-chlorophenyl)methylthio]ethyl]-6-methyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-6-methyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-[2-[(4-chlorobenzyl)thio]ethyl]-4-mesyl-6-methyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C20H23ClN2O4S2 MolecularWeight: 454.99062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(CN2S(=O)(=O)C)C(=O)NCCSCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)OC(CN2S(=O)(=O)C)C(=O)NCCSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN2O4S2/c1-14-3-8-18-17(11-14)23(29(2,25)26)12-19(27-18)20(24)22-9-10-28-13-15-4-6-16(21)7-5-15/h3-8,11,19H,9-10,12-13H2,1-2H3,(H,22,24)