[1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]piperidin-4-yl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: [1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]piperidin-4-yl]-(pyridin-3-ylmethyl)azanium Openeye Name: [1-[4-(2-methylthiazol-4-yl)phenyl]-4-piperidyl]-(3-pyridylmethyl)ammonium CAS Name: [1-[4-(2-methyl-4-thiazolyl)phenyl]-4-piperidinyl]-(3-pyridinylmethyl)ammonium IUPAC Name: [1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]piperidin-4-yl]-(pyridin-3-ylmethyl)azanium Traditional Name: [1-[4-(2-methylthiazol-4-yl)phenyl]-4-piperidyl]-(3-pyridylmethyl)ammonium Formula: C21H25N4S+ MolecularWeight: 365.515

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)N3CCC(CC3)[NH2+]CC4=CN=CC=C4

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)N3CCC(CC3)[NH2+]CC4=CN=CC=C4

InChI

InChI=1S/C21H24N4S/c1-16-24-21(15-26-16)18-4-6-20(7-5-18)25-11-8-19(9-12-25)23-14-17-3-2-10-22-13-17/h2-7,10,13,15,19,23H,8-9,11-12,14H2,1H3/p+1