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

Systemtic Name: 3-[1-(4-methylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-1-(2-methylsulfanylethyl)-1-phenethyl-urea Openeye Name: 3-[1-benzyl-2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-1-(2-methylsulfanylethyl)-1-phenethyl-urea CAS Name: 3-[1-(4-methyl-1-piperazinyl)-1-oxo-3-phenylpropan-2-yl]-1-[2-(methylthio)ethyl]-1-phenethylurea IUPAC Name: 3-[1-(4-methylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]-1-(2-methylsulfanylethyl)-1-phenethylurea Traditional Name: 3-[1-benzyl-2-keto-2-(4-methylpiperazino)ethyl]-1-[2-(methylthio)ethyl]-1-phenethyl-urea Formula: C26H36N4O2S MolecularWeight: 468.65464

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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)CCSC

Isomeric SMILES

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

InChI

InChI=1S/C26H36N4O2S/c1-28-15-17-29(18-16-28)25(31)24(21-23-11-7-4-8-12-23)27-26(32)30(19-20-33-2)14-13-22-9-5-3-6-10-22/h3-12,24H,13-21H2,1-2H3,(H,27,32)