5-azanyl-N-[(1-butylpiperidin-4-yl)methyl]-6-chloranyl-2-propyl-imidazo[1,2-a]pyridine-8-carboxamide; 4-methylbenzenesulfonic acid

Systemtic Name: 5-azanyl-N-[(1-butylpiperidin-4-yl)methyl]-6-chloranyl-2-propyl-imidazo[1,2-a]pyridine-8-carboxamide; 4-methylbenzenesulfonic acid Openeye Name: 5-amino-N-[(1-butyl-4-piperidyl)methyl]-6-chloro-2-propyl-imidazo[1,2-a]pyridine-8-carboxamide; 4-methylbenzenesulfonic acid CAS Name: 5-amino-N-[(1-butyl-4-piperidinyl)methyl]-6-chloro-2-propyl-8-imidazo[1,2-a]pyridinecarboxamide; 4-methylbenzenesulfonic acid IUPAC Name: 5-amino-N-[(1-butylpiperidin-4-yl)methyl]-6-chloro-2-propylimidazo[1,2-a]pyridine-8-carboxamide; 4-methylbenzenesulfonic acid Traditional Name: 5-amino-N-[(1-butyl-4-piperidyl)methyl]-6-chloro-2-propyl-imidazo[1,2-a]pyridine-8-carboxamide; tosylic acid Formula: C28H40ClN5O4S MolecularWeight: 578.1663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)CNC(=O)C2=CC(=C(N3C2=NC(=C3)CCC)N)Cl.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCN1CCC(CC1)CNC(=O)C2=CC(=C(N3C2=NC(=C3)CCC)N)Cl.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C21H32ClN5O.C7H8O3S/c1-3-5-9-26-10-7-15(8-11-26)13-24-21(28)17-12-18(22)19(23)27-14-16(6-4-2)25-20(17)27;1-6-2-4-7(5-3-6)11(8,9)10/h12,14-15H,3-11,13,23H2,1-2H3,(H,24,28);2-5H,1H3,(H,8,9,10)