N-(3-chlorophenyl)-5-[(2-methoxyethylamino)methyl]-4-propan-2-yl-pyrimidin-2-amine; methanoic acid

Systemtic Name: N-(3-chlorophenyl)-5-[(2-methoxyethylamino)methyl]-4-propan-2-yl-pyrimidin-2-amine; methanoic acid Openeye Name: N-(3-chlorophenyl)-4-isopropyl-5-[(2-methoxyethylamino)methyl]pyrimidin-2-amine; formic acid CAS Name: N-(3-chlorophenyl)-5-[(2-methoxyethylamino)methyl]-4-propan-2-yl-2-pyrimidinamine; formic acid IUPAC Name: N-(3-chlorophenyl)-5-[(2-methoxyethylamino)methyl]-4-propan-2-ylpyrimidin-2-amine; formic acid Traditional Name: [2-(3-chloroanilino)-4-isopropyl-pyrimidin-5-yl]methyl-(2-methoxyethyl)amine; formic acid Formula: C18H25ClN4O3 MolecularWeight: 380.8691

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC=C1CNCCOC)NC2=CC(=CC=C2)Cl.C(=O)O

Isomeric SMILES

CC(C)C1=NC(=NC=C1CNCCOC)NC2=CC(=CC=C2)Cl.C(=O)O

InChI

InChI=1S/C17H23ClN4O.CH2O2/c1-12(2)16-13(10-19-7-8-23-3)11-20-17(22-16)21-15-6-4-5-14(18)9-15;2-1-3/h4-6,9,11-12,19H,7-8,10H2,1-3H3,(H,20,21,22);1H,(H,2,3)