ethyl 2-[2-oxidanylidene-3-[(4-oxidanyl-1,3-thiazol-2-yl)carbamoyl]-1-prop-2-enyl-quinolin-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-oxidanylidene-3-[(4-oxidanyl-1,3-thiazol-2-yl)carbamoyl]-1-prop-2-enyl-quinolin-4-yl]ethanoate Openeye Name: ethyl 2-[1-allyl-3-[(4-hydroxythiazol-2-yl)carbamoyl]-2-oxo-4-quinolyl]acetate CAS Name: 2-[3-[[(4-hydroxy-2-thiazolyl)amino]-oxomethyl]-2-oxo-1-prop-2-enyl-4-quinolinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[(4-hydroxy-1,3-thiazol-2-yl)carbamoyl]-2-oxo-1-prop-2-enylquinolin-4-yl]acetate Traditional Name: 2-[1-allyl-3-[(4-hydroxythiazol-2-yl)carbamoyl]-2-keto-4-quinolyl]acetic acid ethyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(=O)N(C2=CC=CC=C21)CC=C)C(=O)NC3=NC(=CS3)O

Isomeric SMILES

CCOC(=O)CC1=C(C(=O)N(C2=CC=CC=C21)CC=C)C(=O)NC3=NC(=CS3)O

InChI

InChI=1S/C20H19N3O5S/c1-3-9-23-14-8-6-5-7-12(14)13(10-16(25)28-4-2)17(19(23)27)18(26)22-20-21-15(24)11-29-20/h3,5-8,11,24H,1,4,9-10H2,2H3,(H,21,22,26)