4-[2-[(3-chlorophenyl)methylsulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one

Systemtic Name: 4-[2-[(3-chlorophenyl)methylsulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Openeye Name: 4-[2-[(3-chlorophenyl)methylsulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one CAS Name: 4-[2-[(3-chlorophenyl)methylthio]-1-oxopropyl]-3,3-dimethyl-1H-quinoxalin-2-one IUPAC Name: 4-[2-[(3-chlorophenyl)methylsulfanyl]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Traditional Name: 4-[2-[(3-chlorobenzyl)thio]propanoyl]-3,3-dimethyl-1H-quinoxalin-2-one Formula: C20H21ClN2O2S MolecularWeight: 388.91094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SCC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C(=O)N1C2=CC=CC=C2NC(=O)C1(C)C)SCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H21ClN2O2S/c1-13(26-12-14-7-6-8-15(21)11-14)18(24)23-17-10-5-4-9-16(17)22-19(25)20(23,2)3/h4-11,13H,12H2,1-3H3,(H,22,25)