N-(2-ethylsulfanylphenyl)-4-ethylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-(2-ethylsulfanylphenyl)-4-ethylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-(2-ethylsulfanylphenyl)-4-ethylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-ethylsulfonyl-N-[2-(ethylthio)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-(2-ethylsulfanylphenyl)-4-ethylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-esyl-N-[2-(ethylthio)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)CC

Isomeric SMILES

CCSC1=CC=CC=C1NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)CC

InChI

InChI=1S/C19H22N2O4S2/c1-3-26-18-12-8-5-9-14(18)20-19(22)17-13-21(27(23,24)4-2)15-10-6-7-11-16(15)25-17/h5-12,17H,3-4,13H2,1-2H3,(H,20,22)