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

Systemtic Name: N-[(1R)-1-cyclopropylethyl]-2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(1R)-1-cyclopropylethyl]-2-[3-(3,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(1R)-1-cyclopropylethyl]-2-[[3-(3,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(1R)-1-cyclopropylethyl]-2-[3-(3,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[(1R)-1-cyclopropylethyl]-2-[[3-(3,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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)C4CC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N[C@H](C)C4CC4)C

InChI

InChI=1S/C23H25N3O2S/c1-14-10-15(2)12-18(11-14)26-22(28)19-6-4-5-7-20(19)25-23(26)29-13-21(27)24-16(3)17-8-9-17/h4-7,10-12,16-17H,8-9,13H2,1-3H3,(H,24,27)/t16-/m1/s1