2-[(5-methylpyridin-2-yl)-piperazin-1-yl-methyl]-1,3-benzothiazole

Systemtic Name: 2-[(5-methylpyridin-2-yl)-piperazin-1-yl-methyl]-1,3-benzothiazole Openeye Name: 2-[(5-methyl-2-pyridyl)-piperazin-1-yl-methyl]-1,3-benzothiazole CAS Name: 2-[(5-methyl-2-pyridinyl)-(1-piperazinyl)methyl]-1,3-benzothiazole IUPAC Name: 2-[(5-methylpyridin-2-yl)-piperazin-1-ylmethyl]-1,3-benzothiazole Traditional Name: 2-[(5-methyl-2-pyridyl)-piperazino-methyl]-1,3-benzothiazole Formula: C18H20N4S MolecularWeight: 324.4432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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