tert-butyl N-[[5-[2-(ethylcarbamoylamino)-3H-benzimidazol-5-yl]pyridin-2-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[5-[2-(ethylcarbamoylamino)-3H-benzimidazol-5-yl]pyridin-2-yl]methyl]carbamate Openeye Name: tert-butyl N-[[5-[2-(ethylcarbamoylamino)-3H-benzimidazol-5-yl]-2-pyridyl]methyl]carbamate CAS Name: N-[[5-[2-(ethylcarbamoylamino)-3H-benzimidazol-5-yl]-2-pyridinyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[5-[2-(ethylcarbamoylamino)-3H-benzimidazol-5-yl]pyridin-2-yl]methyl]carbamate Traditional Name: N-[[5-[2-(ethylcarbamoylamino)-3H-benzimidazol-5-yl]-2-pyridyl]methyl]carbamic acid tert-butyl ester Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(N1)C=C(C=C2)C3=CN=C(C=C3)CNC(=O)OC(C)(C)C

Isomeric SMILES

CCNC(=O)NC1=NC2=C(N1)C=C(C=C2)C3=CN=C(C=C3)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C21H26N6O3/c1-5-22-19(28)27-18-25-16-9-7-13(10-17(16)26-18)14-6-8-15(23-11-14)12-24-20(29)30-21(2,3)4/h6-11H,5,12H2,1-4H3,(H,24,29)(H3,22,25,26,27,28)