(2R)-2-[3-(2,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-phenyl-propanamide

Systemtic Name: (2R)-2-[3-(2,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-phenyl-propanamide Openeye Name: (2R)-2-[3-(2,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-phenyl-propanamide CAS Name: (2R)-2-[[3-(2,4-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-phenylpropanamide IUPAC Name: (2R)-2-[3-(2,4-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-phenylpropanamide Traditional Name: (2R)-2-[[3-(2,4-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-phenyl-propionamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C25H23N3O2S/c1-16-13-14-22(17(2)15-16)28-24(30)20-11-7-8-12-21(20)27-25(28)31-18(3)23(29)26-19-9-5-4-6-10-19/h4-15,18H,1-3H3,(H,26,29)/t18-/m1/s1