4-[(2,4-dichlorophenyl)methylamino]-2-[4-(4-ethylpiperazin-1-yl)phenyl]pyrimidine-5-carboxamide

Systemtic Name: 4-[(2,4-dichlorophenyl)methylamino]-2-[4-(4-ethylpiperazin-1-yl)phenyl]pyrimidine-5-carboxamide Openeye Name: 4-[(2,4-dichlorophenyl)methylamino]-2-[4-(4-ethylpiperazin-1-yl)phenyl]pyrimidine-5-carboxamide CAS Name: 4-[(2,4-dichlorophenyl)methylamino]-2-[4-(4-ethyl-1-piperazinyl)phenyl]-5-pyrimidinecarboxamide IUPAC Name: 4-[(2,4-dichlorophenyl)methylamino]-2-[4-(4-ethylpiperazin-1-yl)phenyl]pyrimidine-5-carboxamide Traditional Name: 4-[(2,4-dichlorobenzyl)amino]-2-[4-(4-ethylpiperazino)phenyl]pyrimidine-5-carboxamide Formula: C24H26Cl2N6O MolecularWeight: 485.40884

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)C3=NC=C(C(=N3)NCC4=C(C=C(C=C4)Cl)Cl)C(=O)N

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)C3=NC=C(C(=N3)NCC4=C(C=C(C=C4)Cl)Cl)C(=O)N

InChI

InChI=1S/C24H26Cl2N6O/c1-2-31-9-11-32(12-10-31)19-7-4-16(5-8-19)23-29-15-20(22(27)33)24(30-23)28-14-17-3-6-18(25)13-21(17)26/h3-8,13,15H,2,9-12,14H2,1H3,(H2,27,33)(H,28,29,30)