5-methyl-2-[methyl-[1-(phenylmethyl)imidazol-4-yl]amino]-1H-imidazole-4-carbaldehyde

Systemtic Name: 5-methyl-2-[methyl-[1-(phenylmethyl)imidazol-4-yl]amino]-1H-imidazole-4-carbaldehyde Openeye Name: 2-[(1-benzylimidazol-4-yl)-methyl-amino]-5-methyl-1H-imidazole-4-carbaldehyde CAS Name: 5-methyl-2-[methyl-[1-(phenylmethyl)-4-imidazolyl]amino]-1H-imidazole-4-carboxaldehyde IUPAC Name: 2-[(1-benzylimidazol-4-yl)-methylamino]-5-methyl-1H-imidazole-4-carbaldehyde Traditional Name: 2-[(1-benzylimidazol-4-yl)-methyl-amino]-5-methyl-1H-imidazole-4-carbaldehyde Formula: C16H17N5O MolecularWeight: 295.33908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)N(C)C2=CN(C=N2)CC3=CC=CC=C3)C=O

Isomeric SMILES

CC1=C(N=C(N1)N(C)C2=CN(C=N2)CC3=CC=CC=C3)C=O

InChI

InChI=1S/C16H17N5O/c1-12-14(10-22)19-16(18-12)20(2)15-9-21(11-17-15)8-13-6-4-3-5-7-13/h3-7,9-11H,8H2,1-2H3,(H,18,19)