N-[3-[(2-azanyl-3H-benzimidazol-5-yl)amino]-2-oxidanyl-3-oxidanylidene-1-phenyl-propyl]-5-butyl-pyridine-2-carboxamide

Systemtic Name: N-[3-[(2-azanyl-3H-benzimidazol-5-yl)amino]-2-oxidanyl-3-oxidanylidene-1-phenyl-propyl]-5-butyl-pyridine-2-carboxamide Openeye Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenyl-propyl]-5-butyl-pyridine-2-carboxamide CAS Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenylpropyl]-5-butyl-2-pyridinecarboxamide IUPAC Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-oxo-1-phenylpropyl]-5-butylpyridine-2-carboxamide Traditional Name: N-[3-[(2-amino-3H-benzimidazol-5-yl)amino]-2-hydroxy-3-keto-1-phenyl-propyl]-5-butyl-picolinamide Formula: C26H28N6O3 MolecularWeight: 472.53892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(C=C1)C(=O)NC(C2=CC=CC=C2)C(C(=O)NC3=CC4=C(C=C3)N=C(N4)N)O

Isomeric SMILES

CCCCC1=CN=C(C=C1)C(=O)NC(C2=CC=CC=C2)C(C(=O)NC3=CC4=C(C=C3)N=C(N4)N)O

InChI

InChI=1S/C26H28N6O3/c1-2-3-7-16-10-12-20(28-15-16)24(34)32-22(17-8-5-4-6-9-17)23(33)25(35)29-18-11-13-19-21(14-18)31-26(27)30-19/h4-6,8-15,22-23,33H,2-3,7H2,1H3,(H,29,35)(H,32,34)(H3,27,30,31)