N-(2-azanyl-3H-benzimidazol-5-yl)-3-(3-ethoxy-4-ethyl-phenyl)-3-(ethylamino)-2-oxidanyl-propanamide

Systemtic Name: N-(2-azanyl-3H-benzimidazol-5-yl)-3-(3-ethoxy-4-ethyl-phenyl)-3-(ethylamino)-2-oxidanyl-propanamide Openeye Name: N-(2-amino-3H-benzimidazol-5-yl)-3-(3-ethoxy-4-ethyl-phenyl)-3-(ethylamino)-2-hydroxy-propanamide CAS Name: N-(2-amino-3H-benzimidazol-5-yl)-3-(3-ethoxy-4-ethylphenyl)-3-(ethylamino)-2-hydroxypropanamide IUPAC Name: N-(2-amino-3H-benzimidazol-5-yl)-3-(3-ethoxy-4-ethylphenyl)-3-(ethylamino)-2-hydroxypropanamide Traditional Name: N-(2-amino-3H-benzimidazol-5-yl)-3-(3-ethoxy-4-ethyl-phenyl)-3-(ethylamino)-2-hydroxy-propionamide Formula: C22H29N5O3 MolecularWeight: 411.49736

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(C(C(=O)NC2=CC3=C(C=C2)N=C(N3)N)O)NCC)OCC

Isomeric SMILES

CCC1=C(C=C(C=C1)C(C(C(=O)NC2=CC3=C(C=C2)N=C(N3)N)O)NCC)OCC

InChI

InChI=1S/C22H29N5O3/c1-4-13-7-8-14(11-18(13)30-6-3)19(24-5-2)20(28)21(29)25-15-9-10-16-17(12-15)27-22(23)26-16/h7-12,19-20,24,28H,4-6H2,1-3H3,(H,25,29)(H3,23,26,27)