N-(5-chloranyl-2-methoxy-phenyl)-3-[(3-methylquinoxalin-2-yl)methylsulfanyl]propanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-3-[(3-methylquinoxalin-2-yl)methylsulfanyl]propanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-3-[(3-methylquinoxalin-2-yl)methylsulfanyl]propanamide CAS Name: N-(5-chloro-2-methoxyphenyl)-3-[(3-methyl-2-quinoxalinyl)methylthio]propanamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-3-[(3-methylquinoxalin-2-yl)methylsulfanyl]propanamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-3-[(3-methylquinoxalin-2-yl)methylthio]propionamide Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSCCC(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSCCC(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H20ClN3O2S/c1-13-18(23-16-6-4-3-5-15(16)22-13)12-27-10-9-20(25)24-17-11-14(21)7-8-19(17)26-2/h3-8,11H,9-10,12H2,1-2H3,(H,24,25)