5-[(cyclobutylmethylamino)methyl]-N-(3,4-dichlorophenyl)-4-propan-2-yl-pyridin-2-amine; methanoic acid

Systemtic Name: 5-[(cyclobutylmethylamino)methyl]-N-(3,4-dichlorophenyl)-4-propan-2-yl-pyridin-2-amine; methanoic acid Openeye Name: 5-[(cyclobutylmethylamino)methyl]-N-(3,4-dichlorophenyl)-4-isopropyl-pyridin-2-amine; formic acid CAS Name: 5-[(cyclobutylmethylamino)methyl]-N-(3,4-dichlorophenyl)-4-propan-2-yl-2-pyridinamine; formic acid IUPAC Name: 5-[(cyclobutylmethylamino)methyl]-N-(3,4-dichlorophenyl)-4-propan-2-ylpyridin-2-amine; formic acid Traditional Name: cyclobutylmethyl-[[6-(3,4-dichloroanilino)-4-isopropyl-3-pyridyl]methyl]amine; formic acid Formula: C106H137Cl10N15O12 MolecularWeight: 2167.84528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NC=C1CNCC2CCC2)NC3=CC(=C(C=C3)Cl)Cl.CC(C)C1=CC(=NC=C1CNCC2CCC2)NC3=CC(=C(C=C3)Cl)Cl.CC(C)C1=CC(=NC=C1CNCC2CCC2)NC3=CC(=C(C=C3)Cl)Cl.CC(C)C1=CC(=NC=C1CNCC2CCC2)NC3=CC(=C(C=C3)Cl)Cl.CC(C)C1=CC(=NC=C1CNCC2CCC2)NC3=CC(=C(C=C3)Cl)Cl.C(=O)O.C(=O)O.C(=O)O.C(=O)O.C(=O)O.C(=O)O

Isomeric SMILES

CC(C)C1=CC(=NC=C1CNCC2CCC2)NC3=CC(=C(C=C3)Cl)Cl.CC(C)C1=CC(=NC=C1CNCC2CCC2)NC3=CC(=C(C=C3)Cl)Cl.CC(C)C1=CC(=NC=C1CNCC2CCC2)NC3=CC(=C(C=C3)Cl)Cl.CC(C)C1=CC(=NC=C1CNCC2CCC2)NC3=CC(=C(C=C3)Cl)Cl.CC(C)C1=CC(=NC=C1CNCC2CCC2)NC3=CC(=C(C=C3)Cl)Cl.C(=O)O.C(=O)O.C(=O)O.C(=O)O.C(=O)O.C(=O)O

InChI

InChI=1S/5C20H25Cl2N3.6CH2O2/c5*1-13(2)17-9-20(25-16-6-7-18(21)19(22)8-16)24-12-15(17)11-23-10-14-4-3-5-14;6*2-1-3/h5*6-9,12-14,23H,3-5,10-11H2,1-2H3,(H,24,25);6*1H,(H,2,3)