(2S)-1-(azepan-1-yl)-2-[4-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)phenoxy]propan-1-one

Systemtic Name: (2S)-1-(azepan-1-yl)-2-[4-(5-ethanoyl-4-methyl-1,3-thiazol-2-yl)phenoxy]propan-1-one Openeye Name: (2S)-2-[4-(5-acetyl-4-methyl-thiazol-2-yl)phenoxy]-1-(azepan-1-yl)propan-1-one CAS Name: (2S)-2-[4-(5-acetyl-4-methyl-2-thiazolyl)phenoxy]-1-(1-azepanyl)-1-propanone IUPAC Name: (2S)-2-[4-(5-acetyl-4-methyl-1,3-thiazol-2-yl)phenoxy]-1-(azepan-1-yl)propan-1-one Traditional Name: (2S)-2-[4-(5-acetyl-4-methyl-thiazol-2-yl)phenoxy]-1-(azepan-1-yl)propan-1-one Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)OC(C)C(=O)N3CCCCCC3)C(=O)C

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)O[C@@H](C)C(=O)N3CCCCCC3)C(=O)C

InChI

InChI=1S/C21H26N2O3S/c1-14-19(15(2)24)27-20(22-14)17-8-10-18(11-9-17)26-16(3)21(25)23-12-6-4-5-7-13-23/h8-11,16H,4-7,12-13H2,1-3H3/t16-/m0/s1