2-[[4-(azepan-1-ylsulfonyl)phenyl]sulfonyl-(furan-2-ylmethyl)amino]-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]sulfonyl-(furan-2-ylmethyl)amino]-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]sulfonyl-(2-furylmethyl)amino]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[4-(1-azepanylsulfonyl)phenyl]sulfonyl-(2-furanylmethyl)amino]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]sulfonyl-(furan-2-ylmethyl)amino]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[4-(azepan-1-ylsulfonyl)phenyl]sulfonyl-(2-furfuryl)amino]-N-(4-methoxyphenyl)acetamide Formula: C26H31N3O7S2 MolecularWeight: 561.67024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CN(CC2=CC=CO2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CN(CC2=CC=CO2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C26H31N3O7S2/c1-35-22-10-8-21(9-11-22)27-26(30)20-29(19-23-7-6-18-36-23)38(33,34)25-14-12-24(13-15-25)37(31,32)28-16-4-2-3-5-17-28/h6-15,18H,2-5,16-17,19-20H2,1H3,(H,27,30)