ethyl 2-[2-[2-(3-cyano-8-methyl-quinolin-2-yl)sulfanylethanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(3-cyano-8-methyl-quinolin-2-yl)sulfanylethanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[2-[(3-cyano-8-methyl-2-quinolyl)sulfanyl]acetyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-[(3-cyano-8-methyl-2-quinolinyl)thio]-1-oxoethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[2-(3-cyano-8-methylquinolin-2-yl)sulfanylacetyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[2-[(3-cyano-8-methyl-2-quinolyl)thio]acetyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C20H18N4O3S2 MolecularWeight: 426.51192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)CSC2=NC3=C(C=CC=C3C)C=C2C#N

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)CSC2=NC3=C(C=CC=C3C)C=C2C#N

InChI

InChI=1S/C20H18N4O3S2/c1-3-27-17(26)8-15-10-29-20(22-15)23-16(25)11-28-19-14(9-21)7-13-6-4-5-12(2)18(13)24-19/h4-7,10H,3,8,11H2,1-2H3,(H,22,23,25)