4-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylpropanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylpropanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylpropanoyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[2-[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]-1-oxopropyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylpropanoyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]propanoyl]-1,3-dihydroquinoxalin-2-one Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SC(C)C(=O)N3CC(=O)NC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2SC(C)C(=O)N3CC(=O)NC4=CC=CC=C43)C

InChI

InChI=1S/C22H22N4O2S/c1-14-10-15(2)12-17(11-14)25-9-8-23-22(25)29-16(3)21(28)26-13-20(27)24-18-6-4-5-7-19(18)26/h4-12,16H,13H2,1-3H3,(H,24,27)