2-[(3-methylpyridin-2-yl)-piperazin-1-yl-methyl]-1,3-benzothiazole

Systemtic Name: 2-[(3-methylpyridin-2-yl)-piperazin-1-yl-methyl]-1,3-benzothiazole Openeye Name: 2-[(3-methyl-2-pyridyl)-piperazin-1-yl-methyl]-1,3-benzothiazole CAS Name: 2-[(3-methyl-2-pyridinyl)-(1-piperazinyl)methyl]-1,3-benzothiazole IUPAC Name: 2-[(3-methylpyridin-2-yl)-piperazin-1-ylmethyl]-1,3-benzothiazole Traditional Name: 2-[(3-methyl-2-pyridyl)-piperazino-methyl]-1,3-benzothiazole Formula: C18H20N4S MolecularWeight: 324.4432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C(C2=NC3=CC=CC=C3S2)N4CCNCC4

Isomeric SMILES

CC1=C(N=CC=C1)C(C2=NC3=CC=CC=C3S2)N4CCNCC4

InChI

InChI=1S/C18H20N4S/c1-13-5-4-8-20-16(13)17(22-11-9-19-10-12-22)18-21-14-6-2-3-7-15(14)23-18/h2-8,17,19H,9-12H2,1H3