N-cycloheptyl-2-[4-oxidanylidene-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-cycloheptyl-2-[4-oxidanylidene-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-cycloheptyl-2-[3-(4-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-cycloheptyl-2-[[4-oxo-3-(4-propan-2-ylphenyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-cycloheptyl-2-[4-oxo-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-cycloheptyl-2-[(4-keto-3-p-cumenyl-quinazolin-2-yl)thio]acetamide Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4CCCCCC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4CCCCCC4

InChI

InChI=1S/C26H31N3O2S/c1-18(2)19-13-15-21(16-14-19)29-25(31)22-11-7-8-12-23(22)28-26(29)32-17-24(30)27-20-9-5-3-4-6-10-20/h7-8,11-16,18,20H,3-6,9-10,17H2,1-2H3,(H,27,30)