N-tert-butyl-2-[4-[[5-(prop-2-enylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[[5-(prop-2-enylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]piperazin-1-yl]ethanamide Openeye Name: 2-[4-[[5-(allylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]piperazin-1-yl]-N-tert-butyl-acetamide CAS Name: N-tert-butyl-2-[4-[[5-(prop-2-enylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-1-piperazinyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[[5-(prop-2-enylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]piperazin-1-yl]acetamide Traditional Name: 2-[4-[[5-(allylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]piperazino]-N-tert-butyl-acetamide Formula: C16H28N6OS2 MolecularWeight: 384.56312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCN(CC1)CN2C(=S)SC(=N2)NCC=C

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCN(CC1)CN2C(=S)SC(=N2)NCC=C

InChI

InChI=1S/C16H28N6OS2/c1-5-6-17-14-19-22(15(24)25-14)12-21-9-7-20(8-10-21)11-13(23)18-16(2,3)4/h5H,1,6-12H2,2-4H3,(H,17,19)(H,18,23)