N3-[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]benzene-1,3-diamine

Systemtic Name: N3-[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]benzene-1,3-diamine Openeye Name: N3-[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]benzene-1,3-diamine CAS Name: N3-[4-(3,4-dimethoxyphenyl)-2-pyrimidinyl]benzene-1,3-diamine IUPAC Name: 3-N-[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]benzene-1,3-diamine Traditional Name: (3-aminophenyl)-[4-(3,4-dimethoxyphenyl)pyrimidin-2-yl]amine Formula: C18H18N4O2 MolecularWeight: 322.36112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NC=C2)NC3=CC=CC(=C3)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NC=C2)NC3=CC=CC(=C3)N)OC

InChI

InChI=1S/C18H18N4O2/c1-23-16-7-6-12(10-17(16)24-2)15-8-9-20-18(22-15)21-14-5-3-4-13(19)11-14/h3-11H,19H2,1-2H3,(H,20,21,22)