1-[4-(2-chlorophenyl)-2-piperidin-1-yl-pyrimidin-5-yl]-3-(2,6-diethylphenyl)urea

Systemtic Name: 1-[4-(2-chlorophenyl)-2-piperidin-1-yl-pyrimidin-5-yl]-3-(2,6-diethylphenyl)urea Openeye Name: 1-[4-(2-chlorophenyl)-2-(1-piperidyl)pyrimidin-5-yl]-3-(2,6-diethylphenyl)urea CAS Name: 1-[4-(2-chlorophenyl)-2-(1-piperidinyl)-5-pyrimidinyl]-3-(2,6-diethylphenyl)urea IUPAC Name: 1-[4-(2-chlorophenyl)-2-piperidin-1-ylpyrimidin-5-yl]-3-(2,6-diethylphenyl)urea Traditional Name: 1-[4-(2-chlorophenyl)-2-piperidino-pyrimidin-5-yl]-3-(2,6-diethylphenyl)urea Formula: C26H30ClN5O MolecularWeight: 464.0023

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)NC2=CN=C(N=C2C3=CC=CC=C3Cl)N4CCCCC4

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)NC2=CN=C(N=C2C3=CC=CC=C3Cl)N4CCCCC4

InChI

InChI=1S/C26H30ClN5O/c1-3-18-11-10-12-19(4-2)23(18)31-26(33)29-22-17-28-25(32-15-8-5-9-16-32)30-24(22)20-13-6-7-14-21(20)27/h6-7,10-14,17H,3-5,8-9,15-16H2,1-2H3,(H2,29,31,33)