(2R)-N-methyl-4-(phenethylcarbamothioyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2R)-N-methyl-4-(phenethylcarbamothioyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2R)-N-methyl-4-(phenethylcarbamothioyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2R)-N-methyl-4-[(phenethylamino)-sulfanylidenemethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2R)-N-methyl-4-(phenethylcarbamothioyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2R)-N-methyl-4-(phenethylthiocarbamoyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=S)NCCC3=CC=CC=C3

Isomeric SMILES

CNC(=O)[C@H]1CN(C2=CC=CC=C2O1)C(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2S/c1-20-18(23)17-13-22(15-9-5-6-10-16(15)24-17)19(25)21-12-11-14-7-3-2-4-8-14/h2-10,17H,11-13H2,1H3,(H,20,23)(H,21,25)/t17-/m1/s1