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

Systemtic Name: 1-[4-(phenylmethyl)piperazin-1-yl]-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propan-1-one CAS Name: 1-[4-(phenylmethyl)-1-piperazinyl]-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)thio]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propan-1-one Traditional Name: 1-(4-benzylpiperazino)-2-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]thio]propan-1-one Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)SC3=NN=C(O3)C4=CC=CS4

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)SC3=NN=C(O3)C4=CC=CS4

InChI

InChI=1S/C20H22N4O2S2/c1-15(28-20-22-21-18(26-20)17-8-5-13-27-17)19(25)24-11-9-23(10-12-24)14-16-6-3-2-4-7-16/h2-8,13,15H,9-12,14H2,1H3