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

Systemtic Name: 1-(3,5-dimethoxyphenyl)-3-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]urea Openeye Name: 1-(3,5-dimethoxyphenyl)-3-[4-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenyl]urea CAS Name: 1-(3,5-dimethoxyphenyl)-3-[4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]phenyl]urea IUPAC Name: 1-(3,5-dimethoxyphenyl)-3-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]urea Traditional Name: 1-(3,5-dimethoxyphenyl)-3-[4-[[4-(2-pyridyl)piperazino]methyl]phenyl]urea Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=N4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=N4)OC

InChI

InChI=1S/C25H29N5O3/c1-32-22-15-21(16-23(17-22)33-2)28-25(31)27-20-8-6-19(7-9-20)18-29-11-13-30(14-12-29)24-5-3-4-10-26-24/h3-10,15-17H,11-14,18H2,1-2H3,(H2,27,28,31)