N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[(1R)-1-(2,4-dichlorophenyl)ethyl]-2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C21H21Cl2N3O2S MolecularWeight: 450.38134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C[C@H](C1=C(C=C(C=C1)Cl)Cl)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C(C)C

InChI

InChI=1S/C21H21Cl2N3O2S/c1-12(2)26-20(28)16-6-4-5-7-18(16)25-21(26)29-11-19(27)24-13(3)15-9-8-14(22)10-17(15)23/h4-10,12-13H,11H2,1-3H3,(H,24,27)/t13-/m1/s1