6-tert-butyl-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 6-tert-butyl-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 6-tert-butyl-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 6-tert-butyl-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 6-tert-butyl-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 6-tert-butyl-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-4-mesyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3CN(C4=C(O3)C=CC(=C4)C(C)(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3CN(C4=C(O3)C=CC(=C4)C(C)(C)C)S(=O)(=O)C

InChI

InChI=1S/C25H30N4O5S/c1-16-22(24(31)29(27(16)5)18-10-8-7-9-11-18)26-23(30)21-15-28(35(6,32)33)19-14-17(25(2,3)4)12-13-20(19)34-21/h7-14,21H,15H2,1-6H3,(H,26,30)