N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-(phenylsulfonyl)propanamide

Systemtic Name: N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-propanamide CAS Name: 3-(benzenesulfonyl)-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methylpropanamide IUPAC Name: 3-(benzenesulfonyl)-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methylpropanamide Traditional Name: 3-besyl-N-[[(2S)-4-ethyl-2,3-dihydro-1,4-benzoxazin-2-yl]methyl]-N-methyl-propionamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(OC2=CC=CC=C21)CN(C)C(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C[C@H](OC2=CC=CC=C21)CN(C)C(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S/c1-3-23-16-17(27-20-12-8-7-11-19(20)23)15-22(2)21(24)13-14-28(25,26)18-9-5-4-6-10-18/h4-12,17H,3,13-16H2,1-2H3/t17-/m1/s1