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

Systemtic Name: 2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-N-phenethylacetamide IUPAC Name: 2-[(6,7-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-N-phenethylacetamide Traditional Name: 2-[(2-keto-6,7-dimethyl-chromen-4-yl)methylthio]-N-phenethyl-acetamide Formula: C22H23NO3S MolecularWeight: 381.48792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)NCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C22H23NO3S/c1-15-10-19-18(12-22(25)26-20(19)11-16(15)2)13-27-14-21(24)23-9-8-17-6-4-3-5-7-17/h3-7,10-12H,8-9,13-14H2,1-2H3,(H,23,24)