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

Systemtic Name: 4-methyl-N-phenyl-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide Openeye Name: 4-methyl-N-phenyl-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide CAS Name: 4-methyl-N-phenyl-3-[1-[[4-[5-(3-pyridazinyl)-1-benzimidazolyl]-2-pyrimidinyl]amino]ethyl]-1-piperazinecarboxamide IUPAC Name: 4-methyl-N-phenyl-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide Traditional Name: 4-methyl-N-phenyl-3-[1-[[4-(5-pyridazin-3-ylbenzimidazol-1-yl)pyrimidin-2-yl]amino]ethyl]piperazine-1-carboxamide Formula: C29H30N10O MolecularWeight: 534.6149

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CN(CCN1C)C(=O)NC2=CC=CC=C2)NC3=NC=CC(=N3)N4C=NC5=C4C=CC(=C5)C6=NN=CC=C6

Isomeric SMILES

CC(C1CN(CCN1C)C(=O)NC2=CC=CC=C2)NC3=NC=CC(=N3)N4C=NC5=C4C=CC(=C5)C6=NN=CC=C6

InChI

InChI=1S/C29H30N10O/c1-20(26-18-38(16-15-37(26)2)29(40)34-22-7-4-3-5-8-22)33-28-30-14-12-27(35-28)39-19-31-24-17-21(10-11-25(24)39)23-9-6-13-32-36-23/h3-14,17,19-20,26H,15-16,18H2,1-2H3,(H,34,40)(H,30,33,35)