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

Systemtic Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[2-[(2,4-dichlorophenyl)methylthio]ethyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-[2-[(2,4-dichlorobenzyl)thio]ethyl]-4-mesyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C19H20Cl2N2O4S2 MolecularWeight: 475.4091

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NCCSCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NCCSCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H20Cl2N2O4S2/c1-29(25,26)23-11-18(27-17-5-3-2-4-16(17)23)19(24)22-8-9-28-12-13-6-7-14(20)10-15(13)21/h2-7,10,18H,8-9,11-12H2,1H3,(H,22,24)