ethyl 2-(3-cyclohexyl-4-oxidanylidene-7-piperidin-1-ylcarbonyl-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(3-cyclohexyl-4-oxidanylidene-7-piperidin-1-ylcarbonyl-quinazolin-2-yl)sulfanylethanoate Openeye Name: ethyl 2-[3-cyclohexyl-4-oxo-7-(piperidine-1-carbonyl)quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-cyclohexyl-4-oxo-7-[oxo(1-piperidinyl)methyl]-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-cyclohexyl-4-oxo-7-(piperidine-1-carbonyl)quinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[3-cyclohexyl-4-keto-7-(piperidine-1-carbonyl)quinazolin-2-yl]thio]acetic acid ethyl ester Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)N3CCCCC3)C(=O)N1C4CCCCC4

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)N3CCCCC3)C(=O)N1C4CCCCC4

InChI

InChI=1S/C24H31N3O4S/c1-2-31-21(28)16-32-24-25-20-15-17(22(29)26-13-7-4-8-14-26)11-12-19(20)23(30)27(24)18-9-5-3-6-10-18/h11-12,15,18H,2-10,13-14,16H2,1H3