ethyl 2-[2-[2-(4-methylquinolin-2-yl)sulfanylbutanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(4-methylquinolin-2-yl)sulfanylbutanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[2-[(4-methyl-2-quinolyl)sulfanyl]butanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-[(4-methyl-2-quinolinyl)thio]-1-oxobutyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(4-methylquinolin-2-yl)sulfanylbutanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[2-[(4-methyl-2-quinolyl)thio]butanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=CS1)CC(=O)OCC)SC2=NC3=CC=CC=C3C(=C2)C

Isomeric SMILES

CCC(C(=O)NC1=NC(=CS1)CC(=O)OCC)SC2=NC3=CC=CC=C3C(=C2)C

InChI

InChI=1S/C21H23N3O3S2/c1-4-17(29-18-10-13(3)15-8-6-7-9-16(15)23-18)20(26)24-21-22-14(12-28-21)11-19(25)27-5-2/h6-10,12,17H,4-5,11H2,1-3H3,(H,22,24,26)