2-[[3-(azepan-1-ylsulfonyl)phenyl]amino]-N-(3,4-diethoxyphenyl)ethanamide

Systemtic Name: 2-[[3-(azepan-1-ylsulfonyl)phenyl]amino]-N-(3,4-diethoxyphenyl)ethanamide Openeye Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-(3,4-diethoxyphenyl)acetamide CAS Name: 2-[3-(1-azepanylsulfonyl)anilino]-N-(3,4-diethoxyphenyl)acetamide IUPAC Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-(3,4-diethoxyphenyl)acetamide Traditional Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-(3,4-diethoxyphenyl)acetamide Formula: C24H33N3O5S MolecularWeight: 475.60092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CNC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CNC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)OCC

InChI

InChI=1S/C24H33N3O5S/c1-3-31-22-13-12-20(17-23(22)32-4-2)26-24(28)18-25-19-10-9-11-21(16-19)33(29,30)27-14-7-5-6-8-15-27/h9-13,16-17,25H,3-8,14-15,18H2,1-2H3,(H,26,28)