4-methyl-N-phenyl-3-[2-[[4-(5-pyridin-4-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide

Systemtic Name: 4-methyl-N-phenyl-3-[2-[[4-(5-pyridin-4-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide Openeye Name: 4-methyl-N-phenyl-3-[2-[[4-[5-(4-pyridyl)benzimidazol-1-yl]pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide CAS Name: 4-methyl-N-phenyl-3-[2-[[4-(5-pyridin-4-yl-1-benzimidazolyl)-2-pyrimidinyl]amino]ethyl]-1-piperazinecarboxamide IUPAC Name: 4-methyl-N-phenyl-3-[2-[[4-(5-pyridin-4-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide Traditional Name: 4-methyl-N-phenyl-3-[2-[[4-[5-(4-pyridyl)benzimidazol-1-yl]pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide Formula: C30H31N9O MolecularWeight: 533.62684

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1CCNC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)C5=CC=NC=C5)C(=O)NC6=CC=CC=C6

Isomeric SMILES

CN1CCN(CC1CCNC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)C5=CC=NC=C5)C(=O)NC6=CC=CC=C6

InChI

InChI=1S/C30H31N9O/c1-37-17-18-38(30(40)35-24-5-3-2-4-6-24)20-25(37)11-15-32-29-33-16-12-28(36-29)39-21-34-26-19-23(7-8-27(26)39)22-9-13-31-14-10-22/h2-10,12-14,16,19,21,25H,11,15,17-18,20H2,1H3,(H,35,40)(H,32,33,36)