1-(1,2-dithiolan-4-yl)-3-[1-(4-methylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-1-phenethyl-urea

Systemtic Name: 1-(1,2-dithiolan-4-yl)-3-[1-(4-methylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-1-phenethyl-urea Openeye Name: 3-[1-benzyl-2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-1-(dithiolan-4-yl)-1-phenethyl-urea CAS Name: 1-(4-dithiolanyl)-3-[1-(4-methyl-1-piperazinyl)-1-oxo-3-phenylpropan-2-yl]-1-phenethylurea IUPAC Name: 1-(dithiolan-4-yl)-3-[1-(4-methylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]-1-phenethylurea Traditional Name: 3-[1-benzyl-2-keto-2-(4-methylpiperazino)ethyl]-1-(dithiolan-4-yl)-1-phenethyl-urea Formula: C26H34N4O2S2 MolecularWeight: 498.70376

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NC(=O)N(CCC3=CC=CC=C3)C4CSSC4

Isomeric SMILES

CN1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NC(=O)N(CCC3=CC=CC=C3)C4CSSC4

InChI

InChI=1S/C26H34N4O2S2/c1-28-14-16-29(17-15-28)25(31)24(18-22-10-6-3-7-11-22)27-26(32)30(23-19-33-34-20-23)13-12-21-8-4-2-5-9-21/h2-11,23-24H,12-20H2,1H3,(H,27,32)