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

Systemtic Name: 2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-N-cyclopentyl-ethanamide Openeye Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-N-cyclopentyl-acetamide CAS Name: 2-[5-(1-azepanylsulfonyl)-2-methoxyanilino]-N-cyclopentylacetamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxyanilino]-N-cyclopentylacetamide Traditional Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-N-cyclopentyl-acetamide Formula: C20H31N3O4S MolecularWeight: 409.54284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NCC(=O)NC3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NCC(=O)NC3CCCC3

InChI

InChI=1S/C20H31N3O4S/c1-27-19-11-10-17(28(25,26)23-12-6-2-3-7-13-23)14-18(19)21-15-20(24)22-16-8-4-5-9-16/h10-11,14,16,21H,2-9,12-13,15H2,1H3,(H,22,24)