3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(3-methylbutyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(3-methylbutyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-isopentyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-(3-methylbutyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3-methylbutyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-isoamyl-benzamide Formula: C18H27ClN2O3S MolecularWeight: 386.93658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CC(C)CCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C18H27ClN2O3S/c1-14(2)9-10-20-18(22)15-7-8-16(19)17(13-15)25(23,24)21-11-5-3-4-6-12-21/h7-8,13-14H,3-6,9-12H2,1-2H3,(H,20,22)