N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(3-methyl-1,2-oxazol-5-yl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylsulfonylpiperazin-1-yl)-N-(3-methylisoxazol-5-yl)acetamide CAS Name: N-(3-methyl-5-isoxazolyl)-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylsulfonylpiperazin-1-yl)-N-(3-methyl-1,2-oxazol-5-yl)acetamide Traditional Name: 2-(4-benzylsulfonylpiperazino)-N-(3-methylisoxazol-5-yl)acetamide Formula: C17H22N4O4S MolecularWeight: 378.44598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=NOC(=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C17H22N4O4S/c1-14-11-17(25-19-14)18-16(22)12-20-7-9-21(10-8-20)26(23,24)13-15-5-3-2-4-6-15/h2-6,11H,7-10,12-13H2,1H3,(H,18,22)