methyl 4-[[2-[1-(4-methoxyquinolin-2-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[2-[1-(4-methoxyquinolin-2-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]butanoate Openeye Name: methyl 4-[[2-[1-(4-methoxyquinoline-2-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]butanoate CAS Name: 4-[[[2-[1-[(4-methoxy-2-quinolinyl)-oxomethyl]-4-piperidinyl]-4-thiazolyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-[1-(4-methoxyquinoline-2-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carbonyl]amino]butanoate Traditional Name: 4-[[2-[1-(4-methoxyquinoline-2-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]butyric acid methyl ester Formula: C25H28N4O5S MolecularWeight: 496.57862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCC(CC3)C4=NC(=CS4)C(=O)NCCCC(=O)OC

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)N3CCC(CC3)C4=NC(=CS4)C(=O)NCCCC(=O)OC

InChI

InChI=1S/C25H28N4O5S/c1-33-21-14-19(27-18-7-4-3-6-17(18)21)25(32)29-12-9-16(10-13-29)24-28-20(15-35-24)23(31)26-11-5-8-22(30)34-2/h3-4,6-7,14-16H,5,8-13H2,1-2H3,(H,26,31)