1-[4-[(5-tert-butyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[(5-tert-butyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[(5-tert-butyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[(5-tert-butyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[(5-tert-butyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[(5-tert-butyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]piperazino]-2-methyl-propan-1-one Formula: C15H27N5OS MolecularWeight: 325.47278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)CN2C(=S)N=C(N2)C(C)(C)C

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)CN2C(=S)N=C(N2)C(C)(C)C

InChI

InChI=1S/C15H27N5OS/c1-11(2)12(21)19-8-6-18(7-9-19)10-20-14(22)16-13(17-20)15(3,4)5/h11H,6-10H2,1-5H3,(H,16,17,22)