N-(5-chloranyl-2-methoxy-phenyl)-4-(6-piperidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-(6-piperidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-[6-(1-piperidyl)pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-(6-piperidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-(6-piperidinopyrimidin-4-yl)piperazine-1-carboxamide Formula: C21H27ClN6O2 MolecularWeight: 430.93108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN6O2/c1-30-18-6-5-16(22)13-17(18)25-21(29)28-11-9-27(10-12-28)20-14-19(23-15-24-20)26-7-3-2-4-8-26/h5-6,13-15H,2-4,7-12H2,1H3,(H,25,29)