3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one Openeye Name: 3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]-1-[4-(2-thienylsulfonyl)piperazin-1-yl]propan-1-one CAS Name: 3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one Traditional Name: 3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]-1-[4-(2-thienylsulfonyl)piperazino]propan-1-one Formula: C18H19N5O4S2 MolecularWeight: 433.50456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=NC(=NO2)C3=CC=NC=C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=NC(=NO2)C3=CC=NC=C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H19N5O4S2/c24-16(4-3-15-20-18(21-27-15)14-5-7-19-8-6-14)22-9-11-23(12-10-22)29(25,26)17-2-1-13-28-17/h1-2,5-8,13H,3-4,9-12H2