5-[2,5-dimethyl-4-(4-piperidin-1-ylpiperidin-1-yl)sulfonyl-thiophen-3-yl]-1,2-oxazole

Systemtic Name: 5-[2,5-dimethyl-4-(4-piperidin-1-ylpiperidin-1-yl)sulfonyl-thiophen-3-yl]-1,2-oxazole Openeye Name: 5-[2,5-dimethyl-4-[[4-(1-piperidyl)-1-piperidyl]sulfonyl]-3-thienyl]isoxazole CAS Name: 5-[2,5-dimethyl-4-[[4-(1-piperidinyl)-1-piperidinyl]sulfonyl]-3-thiophenyl]isoxazole IUPAC Name: 5-[2,5-dimethyl-4-(4-piperidin-1-ylpiperidin-1-yl)sulfonylthiophen-3-yl]-1,2-oxazole Traditional Name: 5-[2,5-dimethyl-4-(4-piperidinopiperidino)sulfonyl-3-thienyl]isoxazole Formula: C19H27N3O3S2 MolecularWeight: 409.56598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)C)S(=O)(=O)N2CCC(CC2)N3CCCCC3)C4=CC=NO4

Isomeric SMILES

CC1=C(C(=C(S1)C)S(=O)(=O)N2CCC(CC2)N3CCCCC3)C4=CC=NO4

InChI

InChI=1S/C19H27N3O3S2/c1-14-18(17-6-9-20-25-17)19(15(2)26-14)27(23,24)22-12-7-16(8-13-22)21-10-4-3-5-11-21/h6,9,16H,3-5,7-8,10-13H2,1-2H3