N-(6-chloranylquinolin-8-yl)-2-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(6-chloranylquinolin-8-yl)-2-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(6-chloro-8-quinolyl)-2-[2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(6-chloro-8-quinolinyl)-2-[[2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-2-oxoethyl]thio]acetamide IUPAC Name: N-(6-chloroquinolin-8-yl)-2-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl]sulfanylacetamide Traditional Name: N-(6-chloro-8-quinolyl)-2-[[2-keto-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]ethyl]thio]acetamide Formula: C24H22ClN5O3S MolecularWeight: 495.98118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSCC(=O)NC3=C4C(=CC(=C3)Cl)C=CC=N4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSCC(=O)NC3=C4C(=CC(=C3)Cl)C=CC=N4

InChI

InChI=1S/C24H22ClN5O3S/c1-15-22(24(33)30(29(15)2)18-8-4-3-5-9-18)28-21(32)14-34-13-20(31)27-19-12-17(25)11-16-7-6-10-26-23(16)19/h3-12H,13-14H2,1-2H3,(H,27,31)(H,28,32)