6-tert-butyl-4-methylsulfonyl-N-[2-(phenylmethyl)butyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 6-tert-butyl-4-methylsulfonyl-N-[2-(phenylmethyl)butyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-(2-benzylbutyl)-6-tert-butyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 6-tert-butyl-4-methylsulfonyl-N-[2-(phenylmethyl)butyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-(2-benzylbutyl)-6-tert-butyl-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: N-(2-benzylbutyl)-6-tert-butyl-4-mesyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C25H34N2O4S MolecularWeight: 458.61346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)CNC(=O)C2CN(C3=C(O2)C=CC(=C3)C(C)(C)C)S(=O)(=O)C

Isomeric SMILES

CCC(CC1=CC=CC=C1)CNC(=O)C2CN(C3=C(O2)C=CC(=C3)C(C)(C)C)S(=O)(=O)C

InChI

InChI=1S/C25H34N2O4S/c1-6-18(14-19-10-8-7-9-11-19)16-26-24(28)23-17-27(32(5,29)30)21-15-20(25(2,3)4)12-13-22(21)31-23/h7-13,15,18,23H,6,14,16-17H2,1-5H3,(H,26,28)