N-(3-chloranyl-4-methoxy-phenyl)-2-[(6-ethyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-[(6-ethyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]ethanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-[(6-ethyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]acetamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[(6-ethyl-4-oxo-1H-quinolin-2-yl)methylthio]acetamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-[(6-ethyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]acetamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-[(6-ethyl-4-keto-1H-quinolin-2-yl)methylthio]acetamide Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=CC2=O)CSCC(=O)NC3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=CC2=O)CSCC(=O)NC3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C21H21ClN2O3S/c1-3-13-4-6-18-16(8-13)19(25)10-15(23-18)11-28-12-21(26)24-14-5-7-20(27-2)17(22)9-14/h4-10H,3,11-12H2,1-2H3,(H,23,25)(H,24,26)