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

Systemtic Name: 6-chloranyl-2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6-chloro-2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6-chloro-2-[[[1-(2,5-dimethylphenyl)-2-imidazolyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6-chloro-2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6-chloro-2-[[[1-(2,5-dimethylphenyl)imidazol-2-yl]thio]methyl]-1H-quinazolin-4-one Formula: C20H17ClN4OS MolecularWeight: 396.89318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17ClN4OS/c1-12-3-4-13(2)17(9-12)25-8-7-22-20(25)27-11-18-23-16-6-5-14(21)10-15(16)19(26)24-18/h3-10H,11H2,1-2H3,(H,23,24,26)