N-(3-chlorophenyl)-4-cyclopropyl-5-[(oxan-4-ylamino)methyl]pyridin-2-amine; ethanoic acid

Systemtic Name: N-(3-chlorophenyl)-4-cyclopropyl-5-[(oxan-4-ylamino)methyl]pyridin-2-amine; ethanoic acid Openeye Name: acetic acid; N-(3-chlorophenyl)-4-cyclopropyl-5-[(tetrahydropyran-4-ylamino)methyl]pyridin-2-amine CAS Name: acetic acid; N-(3-chlorophenyl)-4-cyclopropyl-5-[(4-oxanylamino)methyl]-2-pyridinamine IUPAC Name: acetic acid; N-(3-chlorophenyl)-4-cyclopropyl-5-[(oxan-4-ylamino)methyl]pyridin-2-amine Traditional Name: acetic acid; [6-(3-chloroanilino)-4-cyclopropyl-3-pyridyl]methyl-tetrahydropyran-4-yl-amine Formula: C22H28ClN3O3 MolecularWeight: 417.92902

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1CC1C2=CC(=NC=C2CNC3CCOCC3)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC(=O)O.C1CC1C2=CC(=NC=C2CNC3CCOCC3)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H24ClN3O.C2H4O2/c21-16-2-1-3-18(10-16)24-20-11-19(14-4-5-14)15(13-23-20)12-22-17-6-8-25-9-7-17;1-2(3)4/h1-3,10-11,13-14,17,22H,4-9,12H2,(H,23,24);1H3,(H,3,4)