N-(3,4-dichlorophenyl)-6-methyl-5-(oxiran-2-ylmethoxymethyl)-2-phenyl-pyrimidin-4-amine

Systemtic Name: N-(3,4-dichlorophenyl)-6-methyl-5-(oxiran-2-ylmethoxymethyl)-2-phenyl-pyrimidin-4-amine Openeye Name: N-(3,4-dichlorophenyl)-6-methyl-5-(oxiran-2-ylmethoxymethyl)-2-phenyl-pyrimidin-4-amine CAS Name: N-(3,4-dichlorophenyl)-6-methyl-5-(2-oxiranylmethoxymethyl)-2-phenyl-4-pyrimidinamine IUPAC Name: N-(3,4-dichlorophenyl)-6-methyl-5-(oxiran-2-ylmethoxymethyl)-2-phenylpyrimidin-4-amine Traditional Name: (3,4-dichlorophenyl)-[5-(glycidoxymethyl)-6-methyl-2-phenyl-pyrimidin-4-yl]amine Formula: C21H19Cl2N3O2 MolecularWeight: 416.30046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)NC3=CC(=C(C=C3)Cl)Cl)COCC4CO4

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)NC3=CC(=C(C=C3)Cl)Cl)COCC4CO4

InChI

InChI=1S/C21H19Cl2N3O2/c1-13-17(12-27-10-16-11-28-16)21(25-15-7-8-18(22)19(23)9-15)26-20(24-13)14-5-3-2-4-6-14/h2-9,16H,10-12H2,1H3,(H,24,25,26)