1-(3,4-dimethylphenyl)-3-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]urea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]urea Openeye Name: 1-(3,4-dimethylphenyl)-3-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]urea CAS Name: 1-(3,4-dimethylphenyl)-3-[2-[[6-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy]ethyl]urea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[2-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]oxyethyl]urea Traditional Name: 1-(3,4-dimethylphenyl)-3-[2-[6-(4-methylpiperazino)pyrimidin-4-yl]oxyethyl]urea Formula: C20H28N6O2 MolecularWeight: 384.47532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NCCOC2=NC=NC(=C2)N3CCN(CC3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NCCOC2=NC=NC(=C2)N3CCN(CC3)C)C

InChI

InChI=1S/C20H28N6O2/c1-15-4-5-17(12-16(15)2)24-20(27)21-6-11-28-19-13-18(22-14-23-19)26-9-7-25(3)8-10-26/h4-5,12-14H,6-11H2,1-3H3,(H2,21,24,27)