2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[(6,7-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[(2-keto-6,7-dimethyl-chromen-4-yl)methylthio]-N-[2-(methylthio)phenyl]acetamide Formula: C21H21NO3S2 MolecularWeight: 399.52634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)NC3=CC=CC=C3SC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)NC3=CC=CC=C3SC)C

InChI

InChI=1S/C21H21NO3S2/c1-13-8-16-15(10-21(24)25-18(16)9-14(13)2)11-27-12-20(23)22-17-6-4-5-7-19(17)26-3/h4-10H,11-12H2,1-3H3,(H,22,23)