4-ethylsulfonyl-N-(2-methyl-6-propan-2-yl-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-ethylsulfonyl-N-(2-methyl-6-propan-2-yl-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-ethylsulfonyl-N-(2-isopropyl-6-methyl-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-ethylsulfonyl-N-(2-methyl-6-propan-2-ylphenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-ethylsulfonyl-N-(2-methyl-6-propan-2-ylphenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-esyl-N-(2-isopropyl-6-methyl-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=C(C=CC=C3C(C)C)C

Isomeric SMILES

CCS(=O)(=O)N1CC(OC2=CC=CC=C21)C(=O)NC3=C(C=CC=C3C(C)C)C

InChI

InChI=1S/C21H26N2O4S/c1-5-28(25,26)23-13-19(27-18-12-7-6-11-17(18)23)21(24)22-20-15(4)9-8-10-16(20)14(2)3/h6-12,14,19H,5,13H2,1-4H3,(H,22,24)