N-methyl-N-[(4-methylphenyl)methyl]-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-methyl-N-[(4-methylphenyl)methyl]-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-benzylsulfonyl-N-methyl-N-(p-tolylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-methyl-N-[(4-methylphenyl)methyl]-4-(phenylmethyl)sulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-benzylsulfonyl-N-methyl-N-[(4-methylphenyl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-benzylsulfonyl-N-methyl-N-(4-methylbenzyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N2O4S/c1-19-12-14-20(15-13-19)16-26(2)25(28)24-17-27(22-10-6-7-11-23(22)31-24)32(29,30)18-21-8-4-3-5-9-21/h3-15,24H,16-18H2,1-2H3