2-[2-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]ethylamino]pyrimidine-4-carboxamide

Systemtic Name: 2-[2-[4-(5-chloranyl-2-methoxy-phenyl)piperazin-1-yl]ethylamino]pyrimidine-4-carboxamide Openeye Name: 2-[2-[4-(5-chloro-2-methoxy-phenyl)piperazin-1-yl]ethylamino]pyrimidine-4-carboxamide CAS Name: 2-[2-[4-(5-chloro-2-methoxyphenyl)-1-piperazinyl]ethylamino]-4-pyrimidinecarboxamide IUPAC Name: 2-[2-[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]ethylamino]pyrimidine-4-carboxamide Traditional Name: 2-[2-[4-(5-chloro-2-methoxy-phenyl)piperazino]ethylamino]pyrimidine-4-carboxamide Formula: C18H23ClN6O2 MolecularWeight: 390.86722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCNC3=NC=CC(=N3)C(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2CCN(CC2)CCNC3=NC=CC(=N3)C(=O)N

InChI

InChI=1S/C18H23ClN6O2/c1-27-16-3-2-13(19)12-15(16)25-10-8-24(9-11-25)7-6-22-18-21-5-4-14(23-18)17(20)26/h2-5,12H,6-11H2,1H3,(H2,20,26)(H,21,22,23)