4-[2-[3-(2,5-dimethylphenoxy)propylsulfanyl]ethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[2-[3-(2,5-dimethylphenoxy)propylsulfanyl]ethanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[2-[3-(2,5-dimethylphenoxy)propylsulfanyl]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[2-[3-(2,5-dimethylphenoxy)propylthio]-1-oxoethyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[2-[3-(2,5-dimethylphenoxy)propylsulfanyl]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[2-[3-(2,5-dimethylphenoxy)propylthio]acetyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCCSCC(=O)N2C3=CC=CC=C3NC(=O)C2(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCCSCC(=O)N2C3=CC=CC=C3NC(=O)C2(C)C

InChI

InChI=1S/C23H28N2O3S/c1-16-10-11-17(2)20(14-16)28-12-7-13-29-15-21(26)25-19-9-6-5-8-18(19)24-22(27)23(25,3)4/h5-6,8-11,14H,7,12-13,15H2,1-4H3,(H,24,27)