2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-N-(4-morpholin-4-ylphenyl)ethanamide

Systemtic Name: 2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-N-(4-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-N-(4-morpholinophenyl)acetamide CAS Name: 2-[5-(1-azepanylsulfonyl)-2-methoxyanilino]-N-[4-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxyanilino]-N-(4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-N-(4-morpholinophenyl)acetamide Formula: C25H34N4O5S MolecularWeight: 502.62626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NCC(=O)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NCC(=O)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C25H34N4O5S/c1-33-24-11-10-22(35(31,32)29-12-4-2-3-5-13-29)18-23(24)26-19-25(30)27-20-6-8-21(9-7-20)28-14-16-34-17-15-28/h6-11,18,26H,2-5,12-17,19H2,1H3,(H,27,30)