2-[3-azanyl-6-[3-(piperidin-1-ylmethyl)phenyl]pyrazin-2-yl]-N-(3-fluorophenyl)-3H-benzimidazole-5-carboxamide

Systemtic Name: 2-[3-azanyl-6-[3-(piperidin-1-ylmethyl)phenyl]pyrazin-2-yl]-N-(3-fluorophenyl)-3H-benzimidazole-5-carboxamide Openeye Name: 2-[3-amino-6-[3-(1-piperidylmethyl)phenyl]pyrazin-2-yl]-N-(3-fluorophenyl)-3H-benzimidazole-5-carboxamide CAS Name: 2-[3-amino-6-[3-(1-piperidinylmethyl)phenyl]-2-pyrazinyl]-N-(3-fluorophenyl)-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[3-amino-6-[3-(piperidin-1-ylmethyl)phenyl]pyrazin-2-yl]-N-(3-fluorophenyl)-3H-benzimidazole-5-carboxamide Traditional Name: 2-[3-amino-6-[3-(piperidinomethyl)phenyl]pyrazin-2-yl]-N-(3-fluorophenyl)-3H-benzimidazole-5-carboxamide Formula: C30H28FN7O MolecularWeight: 521.588023

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=CC(=C2)C3=CN=C(C(=N3)C4=NC5=C(N4)C=C(C=C5)C(=O)NC6=CC(=CC=C6)F)N

Isomeric SMILES

C1CCN(CC1)CC2=CC=CC(=C2)C3=CN=C(C(=N3)C4=NC5=C(N4)C=C(C=C5)C(=O)NC6=CC(=CC=C6)F)N

InChI

InChI=1S/C30H28FN7O/c31-22-8-5-9-23(16-22)34-30(39)21-10-11-24-25(15-21)37-29(36-24)27-28(32)33-17-26(35-27)20-7-4-6-19(14-20)18-38-12-2-1-3-13-38/h4-11,14-17H,1-3,12-13,18H2,(H2,32,33)(H,34,39)(H,36,37)