2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-N-(3-methylphenyl)propanamide

Systemtic Name: 2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-N-(3-methylphenyl)propanamide Openeye Name: 2-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfanyl]-N-(m-tolyl)propanamide CAS Name: 2-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylthio]-N-(3-methylphenyl)propanamide IUPAC Name: 2-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-N-(3-methylphenyl)propanamide Traditional Name: 2-[(5-ethoxy-2-methyl-coumaran-6-yl)methylthio]-N-(m-tolyl)propionamide Formula: C22H27NO3S MolecularWeight: 385.51968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC(C)C(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC(C)C(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C22H27NO3S/c1-5-25-20-11-17-10-15(3)26-21(17)12-18(20)13-27-16(4)22(24)23-19-8-6-7-14(2)9-19/h6-9,11-12,15-16H,5,10,13H2,1-4H3,(H,23,24)