2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2R)-1-methoxypropan-2-yl]ethanamide

Systemtic Name: 2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2R)-1-methoxypropan-2-yl]ethanamide Openeye Name: 2-[3-(3,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(1R)-2-methoxy-1-methyl-ethyl]acetamide CAS Name: 2-[[3-(3,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[(2R)-1-methoxypropan-2-yl]acetamide IUPAC Name: 2-[3-(3,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(2R)-1-methoxypropan-2-yl]acetamide Traditional Name: 2-[[3-(3,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-[(1R)-2-methoxy-1-methyl-ethyl]acetamide Formula: C22H25N3O3S MolecularWeight: 411.5172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(C)COC)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N[C@H](C)COC)C

InChI

InChI=1S/C22H25N3O3S/c1-14-9-15(2)11-17(10-14)25-21(27)18-7-5-6-8-19(18)24-22(25)29-13-20(26)23-16(3)12-28-4/h5-11,16H,12-13H2,1-4H3,(H,23,26)/t16-/m1/s1