2-[methyl-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]amino]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[methyl-[(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]amino]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[(7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl-methyl-amino]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl-methylamino]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[(7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl-methylamino]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[(7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl-methyl-amino]-N-[2-(methylthio)phenyl]acetamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CN(C)CC(=O)NC3=CC=CC=C3SC)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CN(C)CC(=O)NC3=CC=CC=C3SC)O

InChI

InChI=1S/C21H22N2O4S/c1-13-17(24)9-8-15-14(10-20(26)27-21(13)15)11-23(2)12-19(25)22-16-6-4-5-7-18(16)28-3/h4-10,24H,11-12H2,1-3H3,(H,22,25)