1-(2-hydroxyethyl)-3-[1-(4-methylpiperazin-1-yl)-3-(4-nitrophenyl)-1-oxidanylidene-propan-2-yl]-1-phenethyl-urea

Systemtic Name: 1-(2-hydroxyethyl)-3-[1-(4-methylpiperazin-1-yl)-3-(4-nitrophenyl)-1-oxidanylidene-propan-2-yl]-1-phenethyl-urea Openeye Name: 1-(2-hydroxyethyl)-3-[2-(4-methylpiperazin-1-yl)-1-[(4-nitrophenyl)methyl]-2-oxo-ethyl]-1-phenethyl-urea CAS Name: 1-(2-hydroxyethyl)-3-[1-(4-methyl-1-piperazinyl)-3-(4-nitrophenyl)-1-oxopropan-2-yl]-1-phenethylurea IUPAC Name: 1-(2-hydroxyethyl)-3-[1-(4-methylpiperazin-1-yl)-3-(4-nitrophenyl)-1-oxopropan-2-yl]-1-phenethylurea Traditional Name: 1-(2-hydroxyethyl)-3-[2-keto-2-(4-methylpiperazino)-1-(4-nitrobenzyl)ethyl]-1-phenethyl-urea Formula: C25H33N5O5 MolecularWeight: 483.56002

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C(CC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)N(CCC3=CC=CC=C3)CCO

Isomeric SMILES

CN1CCN(CC1)C(=O)C(CC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)N(CCC3=CC=CC=C3)CCO

InChI

InChI=1S/C25H33N5O5/c1-27-13-15-28(16-14-27)24(32)23(19-21-7-9-22(10-8-21)30(34)35)26-25(33)29(17-18-31)12-11-20-5-3-2-4-6-20/h2-10,23,31H,11-19H2,1H3,(H,26,33)