4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methyl-phenyl]sulfonyl-6-methyl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methyl-phenyl]sulfonyl-6-methyl-2,3-dihydro-1,4-benzoxazine Openeye Name: 4-[5-(3,4-dimethylisoxazol-5-yl)-2-methyl-phenyl]sulfonyl-6-methyl-2,3-dihydro-1,4-benzoxazine CAS Name: 4-[5-(3,4-dimethyl-5-isoxazolyl)-2-methylphenyl]sulfonyl-6-methyl-2,3-dihydro-1,4-benzoxazine IUPAC Name: 4-[5-(3,4-dimethyl-1,2-oxazol-5-yl)-2-methylphenyl]sulfonyl-6-methyl-2,3-dihydro-1,4-benzoxazine Traditional Name: 4-[5-(3,4-dimethylisoxazol-5-yl)-2-methyl-phenyl]sulfonyl-6-methyl-2,3-dihydro-1,4-benzoxazine Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCCN2S(=O)(=O)C3=C(C=CC(=C3)C4=C(C(=NO4)C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)OCCN2S(=O)(=O)C3=C(C=CC(=C3)C4=C(C(=NO4)C)C)C

InChI

InChI=1S/C21H22N2O4S/c1-13-5-8-19-18(11-13)23(9-10-26-19)28(24,25)20-12-17(7-6-14(20)2)21-15(3)16(4)22-27-21/h5-8,11-12H,9-10H2,1-4H3