N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide

Systemtic Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Openeye Name: N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-4-[methyl(2-thienylsulfonyl)amino]butanamide CAS Name: N-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide IUPAC Name: N-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-4-[methyl(thiophen-2-ylsulfonyl)amino]butanamide Traditional Name: N-[(5-ethoxy-2-methyl-coumaran-6-yl)methyl]-4-[methyl(2-thienylsulfonyl)amino]butyramide Formula: C21H28N2O5S2 MolecularWeight: 452.58742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)CCCN(C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)CCCN(C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H28N2O5S2/c1-4-27-18-12-16-11-15(2)28-19(16)13-17(18)14-22-20(24)7-5-9-23(3)30(25,26)21-8-6-10-29-21/h6,8,10,12-13,15H,4-5,7,9,11,14H2,1-3H3,(H,22,24)