[1-oxidanylidene-1-(pyridin-3-ylamino)butan-2-yl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate

Systemtic Name: [1-oxidanylidene-1-(pyridin-3-ylamino)butan-2-yl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate Openeye Name: 1-(3-pyridylcarbamoyl)propyl 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate CAS Name: 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoic acid [1-oxo-1-(3-pyridinylamino)butan-2-yl] ester IUPAC Name: [1-oxo-1-(pyridin-3-ylamino)butan-2-yl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate Traditional Name: 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoic acid 1-(3-pyridylcarbamoyl)propyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CN=CC=C1)OC(=O)C2=CC=C(C=C2)C3=NC(=C(N3)C)C

Isomeric SMILES

CCC(C(=O)NC1=CN=CC=C1)OC(=O)C2=CC=C(C=C2)C3=NC(=C(N3)C)C

InChI

InChI=1S/C21H22N4O3/c1-4-18(20(26)25-17-6-5-11-22-12-17)28-21(27)16-9-7-15(8-10-16)19-23-13(2)14(3)24-19/h5-12,18H,4H2,1-3H3,(H,23,24)(H,25,26)