2-[2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanamide

Systemtic Name: 2-[2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanamide Openeye Name: 2-[2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-4-oxo-quinazolin-3-yl]acetamide CAS Name: 2-[2-[[[1-(2,5-dimethylphenyl)-2-imidazolyl]thio]methyl]-4-oxo-3-quinazolinyl]acetamide IUPAC Name: 2-[2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]-4-oxoquinazolin-3-yl]acetamide Traditional Name: 2-[2-[[[1-(2,5-dimethylphenyl)imidazol-2-yl]thio]methyl]-4-keto-quinazolin-3-yl]acetamide Formula: C22H21N5O2S MolecularWeight: 419.49944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=CN=C2SCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=CN=C2SCC3=NC4=CC=CC=C4C(=O)N3CC(=O)N

InChI

InChI=1S/C22H21N5O2S/c1-14-7-8-15(2)18(11-14)26-10-9-24-22(26)30-13-20-25-17-6-4-3-5-16(17)21(29)27(20)12-19(23)28/h3-11H,12-13H2,1-2H3,(H2,23,28)