5-(azepan-1-ylsulfonyl)-N-[3-(dimethylamino)propyl]-2-methoxy-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[3-(dimethylamino)propyl]-2-methoxy-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[3-(dimethylamino)propyl]-2-methoxy-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[3-(dimethylamino)propyl]-2-methoxybenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[3-(dimethylamino)propyl]-2-methoxybenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[3-(dimethylamino)propyl]-2-methoxy-benzamide Formula: C19H31N3O4S MolecularWeight: 397.53214

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)OC

Isomeric SMILES

CN(C)CCCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)OC

InChI

InChI=1S/C19H31N3O4S/c1-21(2)12-8-11-20-19(23)17-15-16(9-10-18(17)26-3)27(24,25)22-13-6-4-5-7-14-22/h9-10,15H,4-8,11-14H2,1-3H3,(H,20,23)