2-(6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxy-N-(3-phenylsulfanylpropyl)ethanamide

Systemtic Name: 2-(6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxy-N-(3-phenylsulfanylpropyl)ethanamide Openeye Name: 2-(6-chloro-4-methyl-2-oxo-chromen-7-yl)oxy-N-(3-phenylsulfanylpropyl)acetamide CAS Name: 2-[(6-chloro-4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-N-[3-(phenylthio)propyl]acetamide IUPAC Name: 2-(6-chloro-4-methyl-2-oxochromen-7-yl)oxy-N-(3-phenylsulfanylpropyl)acetamide Traditional Name: 2-(6-chloro-2-keto-4-methyl-chromen-7-yl)oxy-N-[3-(phenylthio)propyl]acetamide Formula: C21H20ClNO4S MolecularWeight: 417.9058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C21H20ClNO4S/c1-14-10-21(25)27-18-12-19(17(22)11-16(14)18)26-13-20(24)23-8-5-9-28-15-6-3-2-4-7-15/h2-4,6-7,10-12H,5,8-9,13H2,1H3,(H,23,24)