2-[4-[(2-azanylidene-6-chloranyl-1,3-benzothiazol-3-yl)methyl]piperidin-1-yl]-1-(4-methylphenyl)ethanol

Systemtic Name: 2-[4-[(2-azanylidene-6-chloranyl-1,3-benzothiazol-3-yl)methyl]piperidin-1-yl]-1-(4-methylphenyl)ethanol Openeye Name: 2-[4-[(6-chloro-2-imino-1,3-benzothiazol-3-yl)methyl]-1-piperidyl]-1-(p-tolyl)ethanol CAS Name: 2-[4-[(6-chloro-2-imino-1,3-benzothiazol-3-yl)methyl]-1-piperidinyl]-1-(4-methylphenyl)ethanol IUPAC Name: 2-[4-[(6-chloro-2-imino-1,3-benzothiazol-3-yl)methyl]piperidin-1-yl]-1-(4-methylphenyl)ethanol Traditional Name: 2-[4-[(6-chloro-2-imino-1,3-benzothiazol-3-yl)methyl]piperidino]-1-(p-tolyl)ethanol Formula: C22H26ClN3OS MolecularWeight: 415.97934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CN2CCC(CC2)CN3C4=C(C=C(C=C4)Cl)SC3=N)O

Isomeric SMILES

CC1=CC=C(C=C1)C(CN2CCC(CC2)CN3C4=C(C=C(C=C4)Cl)SC3=N)O

InChI

InChI=1S/C22H26ClN3OS/c1-15-2-4-17(5-3-15)20(27)14-25-10-8-16(9-11-25)13-26-19-7-6-18(23)12-21(19)28-22(26)24/h2-7,12,16,20,24,27H,8-11,13-14H2,1H3