5-(azepan-1-ylsulfonyl)-N-(2,4-dimethylpentan-3-yl)-2-methyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(2,4-dimethylpentan-3-yl)-2-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(1-isopropyl-2-methyl-propyl)-2-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(2,4-dimethylpentan-3-yl)-2-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(2,4-dimethylpentan-3-yl)-2-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(1-isopropyl-2-methyl-propyl)-2-methyl-benzamide Formula: C21H34N2O3S MolecularWeight: 394.57126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC(C(C)C)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC(C(C)C)C(C)C

InChI

InChI=1S/C21H34N2O3S/c1-15(2)20(16(3)4)22-21(24)19-14-18(11-10-17(19)5)27(25,26)23-12-8-6-7-9-13-23/h10-11,14-16,20H,6-9,12-13H2,1-5H3,(H,22,24)