N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide Openeye Name: N-[1-(p-tolylsulfonyl)-4-piperidyl]-5-(2-thienyl)isoxazole-3-carboxamide CAS Name: N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-5-thiophen-2-yl-3-isoxazolecarboxamide IUPAC Name: N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide Traditional Name: 5-(2-thienyl)-N-(1-tosyl-4-piperidyl)isoxazole-3-carboxamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C20H21N3O4S2/c1-14-4-6-16(7-5-14)29(25,26)23-10-8-15(9-11-23)21-20(24)17-13-18(27-22-17)19-3-2-12-28-19/h2-7,12-13,15H,8-11H2,1H3,(H,21,24)