N-[3-(diethylaminomethyl)-4-methoxy-phenyl]-4-(trichloromethyl)pyrimidin-2-amine

Systemtic Name: N-[3-(diethylaminomethyl)-4-methoxy-phenyl]-4-(trichloromethyl)pyrimidin-2-amine Openeye Name: N-[3-(diethylaminomethyl)-4-methoxy-phenyl]-4-(trichloromethyl)pyrimidin-2-amine CAS Name: N-[3-(diethylaminomethyl)-4-methoxyphenyl]-4-(trichloromethyl)-2-pyrimidinamine IUPAC Name: N-[3-(diethylaminomethyl)-4-methoxyphenyl]-4-(trichloromethyl)pyrimidin-2-amine Traditional Name: diethyl-[2-methoxy-5-[[4-(trichloromethyl)pyrimidin-2-yl]amino]benzyl]amine Formula: C17H21Cl3N4O MolecularWeight: 403.73384

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=CC(=C1)NC2=NC=CC(=N2)C(Cl)(Cl)Cl)OC

Isomeric SMILES

CCN(CC)CC1=C(C=CC(=C1)NC2=NC=CC(=N2)C(Cl)(Cl)Cl)OC

InChI

InChI=1S/C17H21Cl3N4O/c1-4-24(5-2)11-12-10-13(6-7-14(12)25-3)22-16-21-9-8-15(23-16)17(18,19)20/h6-10H,4-5,11H2,1-3H3,(H,21,22,23)