1-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one

Systemtic Name: 1-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one Openeye Name: 1-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propan-1-one CAS Name: 1-[4-(2-ethoxyphenyl)-1-piperazinyl]-3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]-1-propanone IUPAC Name: 1-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one Traditional Name: 1-(4-o-phenetylpiperazino)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propan-1-one Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CCC3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CCC3=NC(=NO3)C4=CSC=C4

InChI

InChI=1S/C21H24N4O3S/c1-2-27-18-6-4-3-5-17(18)24-10-12-25(13-11-24)20(26)8-7-19-22-21(23-28-19)16-9-14-29-15-16/h3-6,9,14-15H,2,7-8,10-13H2,1H3