3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2-methylbutan-2-yl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2-methylbutan-2-yl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(1,1-dimethylpropyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-(2-methylbutan-2-yl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-methylbutan-2-yl)benzamide Traditional Name: N-tert-amyl-3-(azepan-1-ylsulfonyl)-4-chloro-benzamide Formula: C18H27ClN2O3S MolecularWeight: 386.93658

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CCC(C)(C)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C18H27ClN2O3S/c1-4-18(2,3)20-17(22)14-9-10-15(19)16(13-14)25(23,24)21-11-7-5-6-8-12-21/h9-10,13H,4-8,11-12H2,1-3H3,(H,20,22)