2-[4-[[5-(4-tert-butylphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]piperazin-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-[[5-(4-tert-butylphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]piperazin-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-[[5-(4-tert-butylphenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]piperazin-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[[5-(4-tert-butylphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-1-piperazinyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-[[5-(4-tert-butylphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]piperazin-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-[[5-(4-tert-butylphenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]piperazino]-N-cyclopropyl-acetamide Formula: C22H31N5O2S MolecularWeight: 429.57884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=S)O2)CN3CCN(CC3)CC(=O)NC4CC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=S)O2)CN3CCN(CC3)CC(=O)NC4CC4

InChI

InChI=1S/C22H31N5O2S/c1-22(2,3)17-6-4-16(5-7-17)20-24-27(21(30)29-20)15-26-12-10-25(11-13-26)14-19(28)23-18-8-9-18/h4-7,18H,8-15H2,1-3H3,(H,23,28)