2-[(4-iodophenyl)amino]-4-(methylamino)-6-phenylmethoxy-pyrimidine-5-carbaldehyde

Systemtic Name: 2-[(4-iodophenyl)amino]-4-(methylamino)-6-phenylmethoxy-pyrimidine-5-carbaldehyde Openeye Name: 4-benzyloxy-2-(4-iodoanilino)-6-(methylamino)pyrimidine-5-carbaldehyde CAS Name: 2-(4-iodoanilino)-4-(methylamino)-6-phenylmethoxy-5-pyrimidinecarboxaldehyde IUPAC Name: 2-(4-iodoanilino)-4-(methylamino)-6-phenylmethoxypyrimidine-5-carbaldehyde Traditional Name: 4-benzoxy-2-(4-iodoanilino)-6-(methylamino)pyrimidine-5-carbaldehyde Formula: C19H17IN4O2 MolecularWeight: 460.26835

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=NC(=N1)NC2=CC=C(C=C2)I)OCC3=CC=CC=C3)C=O

Isomeric SMILES

CNC1=C(C(=NC(=N1)NC2=CC=C(C=C2)I)OCC3=CC=CC=C3)C=O

InChI

InChI=1S/C19H17IN4O2/c1-21-17-16(11-25)18(26-12-13-5-3-2-4-6-13)24-19(23-17)22-15-9-7-14(20)8-10-15/h2-11H,12H2,1H3,(H2,21,22,23,24)