6-(4-chlorophenyl)-4-piperidin-1-yl-2-propylsulfanyl-5-(pyridin-2-ylmethoxy)-1,3-benzothiazole

Systemtic Name: 6-(4-chlorophenyl)-4-piperidin-1-yl-2-propylsulfanyl-5-(pyridin-2-ylmethoxy)-1,3-benzothiazole Openeye Name: 6-(4-chlorophenyl)-4-(1-piperidyl)-2-propylsulfanyl-5-(2-pyridylmethoxy)-1,3-benzothiazole CAS Name: 6-(4-chlorophenyl)-4-(1-piperidinyl)-2-(propylthio)-5-(2-pyridinylmethoxy)-1,3-benzothiazole IUPAC Name: 6-(4-chlorophenyl)-4-piperidin-1-yl-2-propylsulfanyl-5-(pyridin-2-ylmethoxy)-1,3-benzothiazole Traditional Name: 6-(4-chlorophenyl)-4-piperidino-2-(propylthio)-5-(2-pyridylmethoxy)-1,3-benzothiazole Formula: C27H28ClN3OS2 MolecularWeight: 510.11372

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=C(S1)C=C(C(=C2N3CCCCC3)OCC4=CC=CC=N4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCCSC1=NC2=C(S1)C=C(C(=C2N3CCCCC3)OCC4=CC=CC=N4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H28ClN3OS2/c1-2-16-33-27-30-24-23(34-27)17-22(19-9-11-20(28)12-10-19)26(25(24)31-14-6-3-7-15-31)32-18-21-8-4-5-13-29-21/h4-5,8-13,17H,2-3,6-7,14-16,18H2,1H3