3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(5-methylisoxazol-3-yl)propionamide Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H25N3O4S/c1-15-14-18(21-26-15)20-19(23)11-8-16-6-9-17(10-7-16)27(24,25)22-12-4-2-3-5-13-22/h6-7,9-10,14H,2-5,8,11-13H2,1H3,(H,20,21,23)