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

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(5-methyl-1,3-thiazol-2-yl)propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(5-methylthiazol-2-yl)propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-(5-methyl-2-thiazolyl)propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(5-methyl-1,3-thiazol-2-yl)propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(5-methylthiazol-2-yl)propionamide Formula: C19H25N3O3S2 MolecularWeight: 407.5501

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(S1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CN=C(S1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H25N3O3S2/c1-15-14-20-19(26-15)21-18(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)