2-azanyl-3-[(1-ethylpyrazol-4-yl)methyl]-5,5-diphenyl-imidazol-4-one; methanoic acid

Systemtic Name: 2-azanyl-3-[(1-ethylpyrazol-4-yl)methyl]-5,5-diphenyl-imidazol-4-one; methanoic acid Openeye Name: 2-amino-3-[(1-ethylpyrazol-4-yl)methyl]-5,5-diphenyl-imidazol-4-one; formic acid CAS Name: 2-amino-3-[(1-ethyl-4-pyrazolyl)methyl]-5,5-diphenyl-4-imidazolone; formic acid IUPAC Name: 2-amino-3-[(1-ethylpyrazol-4-yl)methyl]-5,5-diphenylimidazol-4-one; formic acid Traditional Name: 2-amino-3-[(1-ethylpyrazol-4-yl)methyl]-5,5-diphenyl-2-imidazolin-4-one; formic acid Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CN2C(=O)C(N=C2N)(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)O

Isomeric SMILES

CCN1C=C(C=N1)CN2C(=O)C(N=C2N)(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)O

InChI

InChI=1S/C21H21N5O.CH2O2/c1-2-25-14-16(13-23-25)15-26-19(27)21(24-20(26)22,17-9-5-3-6-10-17)18-11-7-4-8-12-18;2-1-3/h3-14H,2,15H2,1H3,(H2,22,24);1H,(H,2,3)