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

Systemtic Name: N-[(3-methylphenyl)methyl]-4-(phenylsulfonyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-(benzenesulfonyl)-N-(m-tolylmethyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-(benzenesulfonyl)-N-[(3-methylphenyl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-(benzenesulfonyl)-N-[(3-methylphenyl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-besyl-N-(3-methylbenzyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O4S/c1-17-8-7-9-18(14-17)15-24-23(26)22-16-25(20-12-5-6-13-21(20)29-22)30(27,28)19-10-3-2-4-11-19/h2-14,22H,15-16H2,1H3,(H,24,26)