cyclopropylmethyl 3-(6-azanylpyridin-3-yl)-2-(1-cyclohexylimidazol-4-yl)propanoate

Systemtic Name: cyclopropylmethyl 3-(6-azanylpyridin-3-yl)-2-(1-cyclohexylimidazol-4-yl)propanoate Openeye Name: cyclopropylmethyl 3-(6-amino-3-pyridyl)-2-(1-cyclohexylimidazol-4-yl)propanoate CAS Name: 3-(6-amino-3-pyridinyl)-2-(1-cyclohexyl-4-imidazolyl)propanoic acid cyclopropylmethyl ester IUPAC Name: cyclopropylmethyl 3-(6-aminopyridin-3-yl)-2-(1-cyclohexylimidazol-4-yl)propanoate Traditional Name: 3-(6-amino-3-pyridyl)-2-(1-cyclohexylimidazol-4-yl)propionic acid cyclopropylmethyl ester Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C=C(N=C2)C(CC3=CN=C(C=C3)N)C(=O)OCC4CC4

Isomeric SMILES

C1CCC(CC1)N2C=C(N=C2)C(CC3=CN=C(C=C3)N)C(=O)OCC4CC4

InChI

InChI=1S/C21H28N4O2/c22-20-9-8-16(11-23-20)10-18(21(26)27-13-15-6-7-15)19-12-25(14-24-19)17-4-2-1-3-5-17/h8-9,11-12,14-15,17-18H,1-7,10,13H2,(H2,22,23)