1-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea

Systemtic Name: 1-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea Openeye Name: 1-[4-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea CAS Name: 1-[4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea IUPAC Name: 1-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea Traditional Name: 1-[4-[[4-(2-pyridyl)piperazino]methyl]phenyl]-3-(3,4,5-trimethoxyphenyl)urea Formula: C26H31N5O4 MolecularWeight: 477.55544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C26H31N5O4/c1-33-22-16-21(17-23(34-2)25(22)35-3)29-26(32)28-20-9-7-19(8-10-20)18-30-12-14-31(15-13-30)24-6-4-5-11-27-24/h4-11,16-17H,12-15,18H2,1-3H3,(H2,28,29,32)