2-(5-diethoxyphosphorylfuran-2-yl)-5-ethenyl-1-(2-methylpropyl)benzimidazol-4-amine

Systemtic Name: 2-(5-diethoxyphosphorylfuran-2-yl)-5-ethenyl-1-(2-methylpropyl)benzimidazol-4-amine Openeye Name: 2-(5-diethoxyphosphoryl-2-furyl)-1-isobutyl-5-vinyl-benzimidazol-4-amine CAS Name: 2-(5-diethoxyphosphoryl-2-furanyl)-5-ethenyl-1-(2-methylpropyl)-4-benzimidazolamine IUPAC Name: 2-(5-diethoxyphosphorylfuran-2-yl)-5-ethenyl-1-(2-methylpropyl)benzimidazol-4-amine Traditional Name: [2-(5-diethoxyphosphoryl-2-furyl)-1-isobutyl-5-vinyl-benzimidazol-4-yl]amine Formula: C21H28N3O4P MolecularWeight: 417.438481

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC=C(O1)C2=NC3=C(N2CC(C)C)C=CC(=C3N)C=C)OCC

Isomeric SMILES

CCOP(=O)(C1=CC=C(O1)C2=NC3=C(N2CC(C)C)C=CC(=C3N)C=C)OCC

InChI

InChI=1S/C21H28N3O4P/c1-6-15-9-10-16-20(19(15)22)23-21(24(16)13-14(4)5)17-11-12-18(28-17)29(25,26-7-2)27-8-3/h6,9-12,14H,1,7-8,13,22H2,2-5H3