N-(5-methyl-1,2-oxazol-3-yl)-4-(4-methylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-4-(4-methylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(5-methylisoxazol-3-yl)-4-(p-tolylsulfonyl)piperazine-1-carboxamide CAS Name: N-(5-methyl-3-isoxazolyl)-4-(4-methylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-4-(4-methylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(5-methylisoxazol-3-yl)-4-tosyl-piperazine-1-carboxamide Formula: C16H20N4O4S MolecularWeight: 364.4194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC3=NOC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC3=NOC(=C3)C

InChI

InChI=1S/C16H20N4O4S/c1-12-3-5-14(6-4-12)25(22,23)20-9-7-19(8-10-20)16(21)17-15-11-13(2)24-18-15/h3-6,11H,7-10H2,1-2H3,(H,17,18,21)