tert-butyl 2-[4-(cyclopropylcarbamoyl)quinolin-2-yl]sulfanylethanoate

Systemtic Name: tert-butyl 2-[4-(cyclopropylcarbamoyl)quinolin-2-yl]sulfanylethanoate Openeye Name: tert-butyl 2-[[4-(cyclopropylcarbamoyl)-2-quinolyl]sulfanyl]acetate CAS Name: 2-[[4-[(cyclopropylamino)-oxomethyl]-2-quinolinyl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(cyclopropylcarbamoyl)quinolin-2-yl]sulfanylacetate Traditional Name: 2-[[4-(cyclopropylcarbamoyl)-2-quinolyl]thio]acetic acid tert-butyl ester Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NC2=CC=CC=C2C(=C1)C(=O)NC3CC3

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NC2=CC=CC=C2C(=C1)C(=O)NC3CC3

InChI

InChI=1S/C19H22N2O3S/c1-19(2,3)24-17(22)11-25-16-10-14(18(23)20-12-8-9-12)13-6-4-5-7-15(13)21-16/h4-7,10,12H,8-9,11H2,1-3H3,(H,20,23)