N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[methyl-[(5-methyl-2-furyl)methyl]amino]acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-[methyl-[(5-methyl-2-furanyl)methyl]amino]acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-[methyl-[(5-methylfuran-2-yl)methyl]amino]acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[methyl-[(5-methyl-2-furyl)methyl]amino]acetamide Formula: C22H31N3O5S MolecularWeight: 449.56364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CC1=CC=C(O1)CN(C)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C22H31N3O5S/c1-17-8-9-18(30-17)15-24(2)16-22(26)23-20-14-19(10-11-21(20)29-3)31(27,28)25-12-6-4-5-7-13-25/h8-11,14H,4-7,12-13,15-16H2,1-3H3,(H,23,26)