1-[4-[(E)-C-cyclopropyl-N-ethoxy-carbonimidoyl]-6-pyridin-3-yl-1H-benzimidazol-2-yl]-3-ethyl-urea

Systemtic Name: 1-[4-[(E)-C-cyclopropyl-N-ethoxy-carbonimidoyl]-6-pyridin-3-yl-1H-benzimidazol-2-yl]-3-ethyl-urea Openeye Name: 1-[4-[(E)-C-cyclopropyl-N-ethoxy-carbonimidoyl]-6-(3-pyridyl)-1H-benzimidazol-2-yl]-3-ethyl-urea CAS Name: 1-[4-[(E)-cyclopropyl(ethoxyimino)methyl]-6-(3-pyridinyl)-1H-benzimidazol-2-yl]-3-ethylurea IUPAC Name: 1-[4-[(E)-C-cyclopropyl-N-ethoxycarbonimidoyl]-6-pyridin-3-yl-1H-benzimidazol-2-yl]-3-ethylurea Traditional Name: 1-[4-[(E)-C-cyclopropyl-N-ethoxy-carbonimidoyl]-6-(3-pyridyl)-1H-benzimidazol-2-yl]-3-ethyl-urea Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CN=CC=C3)C(=NOCC)C4CC4

Isomeric SMILES

CCNC(=O)NC1=NC2=C(C=C(C=C2N1)C3=CN=CC=C3)/C(=N/OCC)/C4CC4

InChI

InChI=1S/C21H24N6O2/c1-3-23-21(28)26-20-24-17-11-15(14-6-5-9-22-12-14)10-16(19(17)25-20)18(13-7-8-13)27-29-4-2/h5-6,9-13H,3-4,7-8H2,1-2H3,(H3,23,24,25,26,28)/b27-18+