[5-[2-(ethylcarbamoylamino)-7-pyrimidin-2-yl-3H-benzimidazol-5-yl]pyridin-3-yl]methyl ethanoate

Systemtic Name: [5-[2-(ethylcarbamoylamino)-7-pyrimidin-2-yl-3H-benzimidazol-5-yl]pyridin-3-yl]methyl ethanoate Openeye Name: [5-[2-(ethylcarbamoylamino)-7-pyrimidin-2-yl-3H-benzimidazol-5-yl]-3-pyridyl]methyl acetate CAS Name: acetic acid [5-[2-(ethylcarbamoylamino)-7-(2-pyrimidinyl)-3H-benzimidazol-5-yl]-3-pyridinyl]methyl ester IUPAC Name: [5-[2-(ethylcarbamoylamino)-7-pyrimidin-2-yl-3H-benzimidazol-5-yl]pyridin-3-yl]methyl acetate Traditional Name: acetic acid [5-[2-(ethylcarbamoylamino)-7-(2-pyrimidyl)-3H-benzimidazol-5-yl]-3-pyridyl]methyl ester Formula: C22H21N7O3 MolecularWeight: 431.44724

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CC(=CN=C3)COC(=O)C)C4=NC=CC=N4

Isomeric SMILES

CCNC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CC(=CN=C3)COC(=O)C)C4=NC=CC=N4

InChI

InChI=1S/C22H21N7O3/c1-3-24-22(31)29-21-27-18-9-15(16-7-14(10-23-11-16)12-32-13(2)30)8-17(19(18)28-21)20-25-5-4-6-26-20/h4-11H,3,12H2,1-2H3,(H3,24,27,28,29,31)