ethyl 2-[2-[2-(3-ethyl-7-methoxy-quinolin-2-yl)sulfanylethanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(3-ethyl-7-methoxy-quinolin-2-yl)sulfanylethanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[2-[(3-ethyl-7-methoxy-2-quinolyl)sulfanyl]acetyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-[(3-ethyl-7-methoxy-2-quinolinyl)thio]-1-oxoethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[2-(3-ethyl-7-methoxyquinolin-2-yl)sulfanylacetyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[2-[(3-ethyl-7-methoxy-2-quinolyl)thio]acetyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=C(C=CC2=C1)OC)SCC(=O)NC3=NC(=CS3)CC(=O)OCC

Isomeric SMILES

CCC1=C(N=C2C=C(C=CC2=C1)OC)SCC(=O)NC3=NC(=CS3)CC(=O)OCC

InChI

InChI=1S/C21H23N3O4S2/c1-4-13-8-14-6-7-16(27-3)10-17(14)23-20(13)29-12-18(25)24-21-22-15(11-30-21)9-19(26)28-5-2/h6-8,10-11H,4-5,9,12H2,1-3H3,(H,22,24,25)