2-[4-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbonyl-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbonyl-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-(4-methoxy-3-morpholinosulfonyl-benzoyl)-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide IUPAC Name: 2-[4-(4-methoxy-3-morpholin-4-ylsulfonylbenzoyl)-1,4-diazepan-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-(4-methoxy-3-morpholinosulfonyl-benzoyl)-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide Formula: C21H32N4O6S MolecularWeight: 468.56698

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H32N4O6S/c1-22(2)20(26)16-23-7-4-8-24(10-9-23)21(27)17-5-6-18(30-3)19(15-17)32(28,29)25-11-13-31-14-12-25/h5-6,15H,4,7-14,16H2,1-3H3