N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-yl(ethylsulfonyl)amino]acetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[1,3-benzodioxol-5-yl(esyl)amino]acetamide Formula: C23H29N3O7S2 MolecularWeight: 523.62226

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H29N3O7S2/c1-2-34(28,29)26(19-9-12-21-22(15-19)33-17-32-21)16-23(27)24-18-7-10-20(11-8-18)35(30,31)25-13-5-3-4-6-14-25/h7-12,15H,2-6,13-14,16-17H2,1H3,(H,24,27)