2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-N-(2-methoxyphenyl)ethanamide

Systemtic Name: 2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-N-(2-methoxyphenyl)acetamide CAS Name: 2-[5-(1-azepanylsulfonyl)-2-methoxyanilino]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxyanilino]-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-N-(2-methoxyphenyl)acetamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NCC(=O)NC3=CC=CC=C3OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NCC(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C22H29N3O5S/c1-29-20-10-6-5-9-18(20)24-22(26)16-23-19-15-17(11-12-21(19)30-2)31(27,28)25-13-7-3-4-8-14-25/h5-6,9-12,15,23H,3-4,7-8,13-14,16H2,1-2H3,(H,24,26)