3,3-dimethyl-4-[2-[(E)-3-phenylprop-2-enyl]sulfanylethanoyl]-1H-quinoxalin-2-one

Systemtic Name: 3,3-dimethyl-4-[2-[(E)-3-phenylprop-2-enyl]sulfanylethanoyl]-1H-quinoxalin-2-one Openeye Name: 4-[2-[(E)-cinnamyl]sulfanylacetyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 3,3-dimethyl-4-[1-oxo-2-[[(E)-3-phenylprop-2-enyl]thio]ethyl]-1H-quinoxalin-2-one IUPAC Name: 3,3-dimethyl-4-[2-[(E)-3-phenylprop-2-enyl]sulfanylacetyl]-1H-quinoxalin-2-one Traditional Name: 4-[2-[[(E)-cinnamyl]thio]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSCC=CC3=CC=CC=C3)C

Isomeric SMILES

CC1(C(=O)NC2=CC=CC=C2N1C(=O)CSC/C=C/C3=CC=CC=C3)C

InChI

InChI=1S/C21H22N2O2S/c1-21(2)20(25)22-17-12-6-7-13-18(17)23(21)19(24)15-26-14-8-11-16-9-4-3-5-10-16/h3-13H,14-15H2,1-2H3,(H,22,25)/b11-8+