N-(5-chloranyl-2-methoxy-phenyl)-2-[3-(cyclopentylmethyl)quinolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[3-(cyclopentylmethyl)quinolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-[[3-(cyclopentylmethyl)-2-quinolyl]sulfanyl]acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[[3-(cyclopentylmethyl)-2-quinolinyl]thio]acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-[3-(cyclopentylmethyl)quinolin-2-yl]sulfanylacetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[[3-(cyclopentylmethyl)-2-quinolyl]thio]acetamide Formula: C24H25ClN2O2S MolecularWeight: 440.9855

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC3=CC=CC=C3C=C2CC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC3=CC=CC=C3C=C2CC4CCCC4

InChI

InChI=1S/C24H25ClN2O2S/c1-29-22-11-10-19(25)14-21(22)26-23(28)15-30-24-18(12-16-6-2-3-7-16)13-17-8-4-5-9-20(17)27-24/h4-5,8-11,13-14,16H,2-3,6-7,12,15H2,1H3,(H,26,28)