N-cyclohexyl-2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-ethyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-ethyl-ethanamide Openeye Name: N-cyclohexyl-2-[3-(3,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-ethyl-acetamide CAS Name: N-cyclohexyl-2-[[3-(3,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-ethylacetamide IUPAC Name: N-cyclohexyl-2-[3-(3,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-ethylacetamide Traditional Name: N-cyclohexyl-2-[[3-(3,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-ethyl-acetamide Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC(=C4)C)C

Isomeric SMILES

CCN(C1CCCCC1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC(=C4)C)C

InChI

InChI=1S/C26H31N3O2S/c1-4-28(20-10-6-5-7-11-20)24(30)17-32-26-27-23-13-9-8-12-22(23)25(31)29(26)21-15-18(2)14-19(3)16-21/h8-9,12-16,20H,4-7,10-11,17H2,1-3H3