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

Systemtic Name: N-cyclohexyl-2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-cyclohexyl-2-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-cyclohexyl-2-[(3-homoveratryl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4CCCCC4)OC

InChI

InChI=1S/C26H31N3O4S/c1-32-22-13-12-18(16-23(22)33-2)14-15-29-25(31)20-10-6-7-11-21(20)28-26(29)34-17-24(30)27-19-8-4-3-5-9-19/h6-7,10-13,16,19H,3-5,8-9,14-15,17H2,1-2H3,(H,27,30)