(2R)-N-methyl-4-[(E)-3-phenylsulfanylprop-2-enoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2R)-N-methyl-4-[(E)-3-phenylsulfanylprop-2-enoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2R)-N-methyl-4-[(E)-3-phenylsulfanylprop-2-enoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2R)-N-methyl-4-[(E)-1-oxo-3-(phenylthio)prop-2-enyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2R)-N-methyl-4-[(E)-3-phenylsulfanylprop-2-enoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2R)-N-methyl-4-[(E)-3-(phenylthio)acryloyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)C=CSC3=CC=CC=C3

Isomeric SMILES

CNC(=O)[C@H]1CN(C2=CC=CC=C2O1)C(=O)/C=C/SC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3S/c1-20-19(23)17-13-21(15-9-5-6-10-16(15)24-17)18(22)11-12-25-14-7-3-2-4-8-14/h2-12,17H,13H2,1H3,(H,20,23)/b12-11+/t17-/m1/s1