N4-(1,3-benzodioxol-5-ylmethyl)-6-phenyl-pyrimidine-2,4-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-phenyl-pyrimidine-2,4-diamine Openeye Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-phenyl-pyrimidine-2,4-diamine CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-6-phenylpyrimidine-2,4-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-6-phenylpyrimidine-2,4-diamine Traditional Name: (2-amino-6-phenyl-pyrimidin-4-yl)-piperonyl-amine Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC(=C3)C4=CC=CC=C4)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NC(=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C18H16N4O2/c19-18-21-14(13-4-2-1-3-5-13)9-17(22-18)20-10-12-6-7-15-16(8-12)24-11-23-15/h1-9H,10-11H2,(H3,19,20,21,22)