4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]butan-1-one Openeye Name: 4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-[4-(3-thienylmethyl)piperazin-1-yl]butan-1-one CAS Name: 4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-[4-(3-thiophenylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]butan-1-one Traditional Name: 4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1-[4-(3-thenyl)piperazino]butan-1-one Formula: C21H24N4O2S MolecularWeight: 396.50586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C(=O)CCCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C(=O)CCCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C21H24N4O2S/c26-20(25-12-10-24(11-13-25)15-17-9-14-28-16-17)8-4-7-19-22-21(23-27-19)18-5-2-1-3-6-18/h1-3,5-6,9,14,16H,4,7-8,10-13,15H2