5-(azepan-1-ylsulfonyl)-N-[1-(4-methoxyphenyl)-3-methyl-butyl]-2-methyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[1-(4-methoxyphenyl)-3-methyl-butyl]-2-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[1-(4-methoxyphenyl)-3-methyl-butyl]-2-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[1-(4-methoxyphenyl)-3-methylbutyl]-2-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[1-(4-methoxyphenyl)-3-methylbutyl]-2-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[1-(4-methoxyphenyl)-3-methyl-butyl]-2-methyl-benzamide Formula: C26H36N2O4S MolecularWeight: 472.64004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC(CC(C)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC(CC(C)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C26H36N2O4S/c1-19(2)17-25(21-10-12-22(32-4)13-11-21)27-26(29)24-18-23(14-9-20(24)3)33(30,31)28-15-7-5-6-8-16-28/h9-14,18-19,25H,5-8,15-17H2,1-4H3,(H,27,29)