N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-3-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-(2,6-dimethylmorpholino)sulfonyl-benzamide Formula: C26H35N3O6S2 MolecularWeight: 549.7026

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)C)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC(=C(C=C3)C)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C26H35N3O6S2/c1-19-11-12-23(16-25(19)37(33,34)28-13-6-4-5-7-14-28)27-26(30)22-9-8-10-24(15-22)36(31,32)29-17-20(2)35-21(3)18-29/h8-12,15-16,20-21H,4-7,13-14,17-18H2,1-3H3,(H,27,30)