2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-8-methyl-1H-quinazolin-4-one

Systemtic Name: 2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-8-methyl-1H-quinazolin-4-one Openeye Name: 2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-8-methyl-1H-quinazolin-4-one CAS Name: 2-[[[1-(2,5-dimethylphenyl)-2-imidazolyl]thio]methyl]-8-methyl-1H-quinazolin-4-one IUPAC Name: 2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-8-methyl-1H-quinazolin-4-one Traditional Name: 2-[[[1-(2,5-dimethylphenyl)imidazol-2-yl]thio]methyl]-8-methyl-1H-quinazolin-4-one Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=CN=C2SCC3=NC(=O)C4=C(N3)C(=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=CN=C2SCC3=NC(=O)C4=C(N3)C(=CC=C4)C

InChI

InChI=1S/C21H20N4OS/c1-13-7-8-14(2)17(11-13)25-10-9-22-21(25)27-12-18-23-19-15(3)5-4-6-16(19)20(26)24-18/h4-11H,12H2,1-3H3,(H,23,24,26)