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

Systemtic Name: 3-[1-(4-methylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-1-phenethyl-1-[2-(phenyldisulfanyl)ethyl]urea Openeye Name: 3-[1-benzyl-2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-1-phenethyl-1-[2-(phenyldisulfanyl)ethyl]urea CAS Name: 3-[1-(4-methyl-1-piperazinyl)-1-oxo-3-phenylpropan-2-yl]-1-phenethyl-1-[2-(phenyldisulfanyl)ethyl]urea IUPAC Name: 3-[1-(4-methylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]-1-phenethyl-1-[2-(phenyldisulfanyl)ethyl]urea Traditional Name: 3-[1-benzyl-2-keto-2-(4-methylpiperazino)ethyl]-1-phenethyl-1-[2-(phenyldisulfanyl)ethyl]urea Formula: C31H38N4O2S2 MolecularWeight: 562.78902

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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)CCSSC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NC(=O)N(CCC3=CC=CC=C3)CCSSC4=CC=CC=C4

InChI

InChI=1S/C31H38N4O2S2/c1-33-19-21-34(22-20-33)30(36)29(25-27-13-7-3-8-14-27)32-31(37)35(18-17-26-11-5-2-6-12-26)23-24-38-39-28-15-9-4-10-16-28/h2-16,29H,17-25H2,1H3,(H,32,37)