4-ethylsulfonyl-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-ethylsulfonyl-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-ethylsulfonyl-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-ethylsulfonyl-N-[2-methyl-4-[(phenylthio)methyl]phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-ethylsulfonyl-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-esyl-N-[2-methyl-4-[(phenylthio)methyl]phenyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C25H26N2O4S2 MolecularWeight: 482.61494

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=C(C=C(C=C3)CSC4=CC=CC=C4)C

Isomeric SMILES

CCS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=C(C=C(C=C3)CSC4=CC=CC=C4)C

InChI

InChI=1S/C25H26N2O4S2/c1-3-33(29,30)27-16-24(31-23-12-8-7-11-22(23)27)25(28)26-21-14-13-19(15-18(21)2)17-32-20-9-5-4-6-10-20/h4-15,24H,3,16-17H2,1-2H3,(H,26,28)