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

Systemtic Name: ethyl 2-(3-cyclohexyl-4-oxidanylidene-7-pyrrolidin-1-ylcarbonyl-quinazolin-2-yl)sulfanylethanoate Openeye Name: ethyl 2-[3-cyclohexyl-4-oxo-7-(pyrrolidine-1-carbonyl)quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-cyclohexyl-4-oxo-7-[oxo(1-pyrrolidinyl)methyl]-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-cyclohexyl-4-oxo-7-(pyrrolidine-1-carbonyl)quinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[3-cyclohexyl-4-keto-7-(pyrrolidine-1-carbonyl)quinazolin-2-yl]thio]acetic acid ethyl ester Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)N3CCCC3)C(=O)N1C4CCCCC4

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)N3CCCC3)C(=O)N1C4CCCCC4

InChI

InChI=1S/C23H29N3O4S/c1-2-30-20(27)15-31-23-24-19-14-16(21(28)25-12-6-7-13-25)10-11-18(19)22(29)26(23)17-8-4-3-5-9-17/h10-11,14,17H,2-9,12-13,15H2,1H3