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

Systemtic Name: N-(2-methyl-6-propan-2-yl-phenyl)-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-benzylsulfonyl-N-(2-isopropyl-6-methyl-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-(2-methyl-6-propan-2-ylphenyl)-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-benzylsulfonyl-N-(2-methyl-6-propan-2-ylphenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-benzylsulfonyl-N-(2-isopropyl-6-methyl-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C26H28N2O4S MolecularWeight: 464.57652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H28N2O4S/c1-18(2)21-13-9-10-19(3)25(21)27-26(29)24-16-28(22-14-7-8-15-23(22)32-24)33(30,31)17-20-11-5-4-6-12-20/h4-15,18,24H,16-17H2,1-3H3,(H,27,29)