N-(5-chloranyl-2-methoxy-phenyl)-2-[2-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[2-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-[2-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[[2-[2-[(4-methoxy-2-quinolinyl)-oxomethyl]-1-pyrazolidinyl]-2-oxoethyl]thio]acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-[2-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-oxoethyl]sulfanylacetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[[2-keto-2-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]ethyl]thio]acetamide Formula: C25H25ClN4O5S MolecularWeight: 529.0078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CSCC(=O)N2CCCN2C(=O)C3=NC4=CC=CC=C4C(=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CSCC(=O)N2CCCN2C(=O)C3=NC4=CC=CC=C4C(=C3)OC

InChI

InChI=1S/C25H25ClN4O5S/c1-34-21-9-8-16(26)12-19(21)28-23(31)14-36-15-24(32)29-10-5-11-30(29)25(33)20-13-22(35-2)17-6-3-4-7-18(17)27-20/h3-4,6-9,12-13H,5,10-11,14-15H2,1-2H3,(H,28,31)