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

Systemtic Name: N-tert-butyl-2-[4-[[5-(phenylmethyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[(5-benzyl-2-thioxo-1,3,4-oxadiazol-3-yl)methyl]piperazin-1-yl]-N-tert-butyl-acetamide CAS Name: N-tert-butyl-2-[4-[[5-(phenylmethyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]-1-piperazinyl]acetamide IUPAC Name: 2-[4-[(5-benzyl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]piperazin-1-yl]-N-tert-butylacetamide Traditional Name: 2-[4-[(5-benzyl-2-thioxo-1,3,4-oxadiazol-3-yl)methyl]piperazino]-N-tert-butyl-acetamide Formula: C20H29N5O2S MolecularWeight: 403.54156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCN(CC1)CN2C(=S)OC(=N2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCN(CC1)CN2C(=S)OC(=N2)CC3=CC=CC=C3

InChI

InChI=1S/C20H29N5O2S/c1-20(2,3)21-17(26)14-23-9-11-24(12-10-23)15-25-19(28)27-18(22-25)13-16-7-5-4-6-8-16/h4-8H,9-15H2,1-3H3,(H,21,26)