(5-chloranyl-2-methoxy-phenyl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: (5-chloro-2-methoxy-phenyl)-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: (5-chloro-2-methoxyphenyl)-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-methoxyphenyl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: (5-chloro-2-methoxy-phenyl)-[4-(6-piperidinopyrimidin-4-yl)piperazino]methanone Formula: C21H26ClN5O2 MolecularWeight: 415.91644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

InChI

InChI=1S/C21H26ClN5O2/c1-29-18-6-5-16(22)13-17(18)21(28)27-11-9-26(10-12-27)20-14-19(23-15-24-20)25-7-3-2-4-8-25/h5-6,13-15H,2-4,7-12H2,1H3