3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-morpholin-4-ylethyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-morpholin-4-ylethyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-morpholinoethyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-[2-(4-morpholinyl)ethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-morpholin-4-ylethyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-morpholinoethyl)benzamide Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCN2CCOCC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCN2CCOCC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H31N3O5S/c1-27-18-7-6-17(20(24)21-8-11-22-12-14-28-15-13-22)16-19(18)29(25,26)23-9-4-2-3-5-10-23/h6-7,16H,2-5,8-15H2,1H3,(H,21,24)