6-chloranyl-2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6-chloro-2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6-chloro-2-[[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6-chloro-2-[[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6-chloro-2-[[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]methyl]-1H-quinazolin-4-one Formula: C20H17ClN4OS MolecularWeight: 396.89318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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