1-ethyl-3-[4-(3-methylbutanoyl)-6-pyridin-3-yl-1H-benzimidazol-2-yl]urea

Systemtic Name: 1-ethyl-3-[4-(3-methylbutanoyl)-6-pyridin-3-yl-1H-benzimidazol-2-yl]urea Openeye Name: 1-ethyl-3-[4-(3-methylbutanoyl)-6-(3-pyridyl)-1H-benzimidazol-2-yl]urea CAS Name: 1-ethyl-3-[4-(3-methyl-1-oxobutyl)-6-(3-pyridinyl)-1H-benzimidazol-2-yl]urea IUPAC Name: 1-ethyl-3-[4-(3-methylbutanoyl)-6-pyridin-3-yl-1H-benzimidazol-2-yl]urea Traditional Name: 1-ethyl-3-[4-isovaleryl-6-(3-pyridyl)-1H-benzimidazol-2-yl]urea Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CN=CC=C3)C(=O)CC(C)C

Isomeric SMILES

CCNC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CN=CC=C3)C(=O)CC(C)C

InChI

InChI=1S/C20H23N5O2/c1-4-22-20(27)25-19-23-16-10-14(13-6-5-7-21-11-13)9-15(18(16)24-19)17(26)8-12(2)3/h5-7,9-12H,4,8H2,1-3H3,(H3,22,23,24,25,27)