1-[4-(6-chloranylpyrimidin-4-yl)oxyphenyl]-3-[4-[(4-ethylpiperazin-1-yl)methyl]-3-methyl-phenyl]urea

Systemtic Name: 1-[4-(6-chloranylpyrimidin-4-yl)oxyphenyl]-3-[4-[(4-ethylpiperazin-1-yl)methyl]-3-methyl-phenyl]urea Openeye Name: 1-[4-(6-chloropyrimidin-4-yl)oxyphenyl]-3-[4-[(4-ethylpiperazin-1-yl)methyl]-3-methyl-phenyl]urea CAS Name: 1-[4-[(6-chloro-4-pyrimidinyl)oxy]phenyl]-3-[4-[(4-ethyl-1-piperazinyl)methyl]-3-methylphenyl]urea IUPAC Name: 1-[4-(6-chloropyrimidin-4-yl)oxyphenyl]-3-[4-[(4-ethylpiperazin-1-yl)methyl]-3-methylphenyl]urea Traditional Name: 1-[4-(6-chloropyrimidin-4-yl)oxyphenyl]-3-[4-[(4-ethylpiperazino)methyl]-3-methyl-phenyl]urea Formula: C25H29ClN6O2 MolecularWeight: 480.98976

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(C=C(C=C2)NC(=O)NC3=CC=C(C=C3)OC4=CC(=NC=N4)Cl)C

Isomeric SMILES

CCN1CCN(CC1)CC2=C(C=C(C=C2)NC(=O)NC3=CC=C(C=C3)OC4=CC(=NC=N4)Cl)C

InChI

InChI=1S/C25H29ClN6O2/c1-3-31-10-12-32(13-11-31)16-19-4-5-21(14-18(19)2)30-25(33)29-20-6-8-22(9-7-20)34-24-15-23(26)27-17-28-24/h4-9,14-15,17H,3,10-13,16H2,1-2H3,(H2,29,30,33)