(3E)-1-tert-butyl-3-[5-(4-methylpiperazin-1-yl)-1,2,4-dithiazol-3-ylidene]urea

Systemtic Name: (3E)-1-tert-butyl-3-[5-(4-methylpiperazin-1-yl)-1,2,4-dithiazol-3-ylidene]urea Openeye Name: (3E)-1-tert-butyl-3-[5-(4-methylpiperazin-1-yl)-1,2,4-dithiazol-3-ylidene]urea CAS Name: (3E)-1-tert-butyl-3-[5-(4-methyl-1-piperazinyl)-1,2,4-dithiazol-3-ylidene]urea IUPAC Name: (3E)-1-tert-butyl-3-[5-(4-methylpiperazin-1-yl)-1,2,4-dithiazol-3-ylidene]urea Traditional Name: (3E)-1-tert-butyl-3-[5-(4-methylpiperazino)-1,2,4-dithiazol-3-ylidene]urea Formula: C12H21N5OS2 MolecularWeight: 315.45804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N=C1N=C(SS1)N2CCN(CC2)C

Isomeric SMILES

CC(C)(C)NC(=O)/N=C/1\N=C(SS1)N2CCN(CC2)C

InChI

InChI=1S/C12H21N5OS2/c1-12(2,3)15-9(18)13-10-14-11(20-19-10)17-7-5-16(4)6-8-17/h5-8H2,1-4H3,(H,15,18)/b13-10+