1-[4-(1,3-benzoxazol-2-ylmethylamino)piperidin-1-yl]-3-phenylsulfanyl-propan-2-ol

Systemtic Name: 1-[4-(1,3-benzoxazol-2-ylmethylamino)piperidin-1-yl]-3-phenylsulfanyl-propan-2-ol Openeye Name: 1-[4-(1,3-benzoxazol-2-ylmethylamino)-1-piperidyl]-3-phenylsulfanyl-propan-2-ol CAS Name: 1-[4-(1,3-benzoxazol-2-ylmethylamino)-1-piperidinyl]-3-(phenylthio)-2-propanol IUPAC Name: 1-[4-(1,3-benzoxazol-2-ylmethylamino)piperidin-1-yl]-3-phenylsulfanylpropan-2-ol Traditional Name: 1-[4-(1,3-benzoxazol-2-ylmethylamino)piperidino]-3-(phenylthio)propan-2-ol Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCC2=NC3=CC=CC=C3O2)CC(CSC4=CC=CC=C4)O

Isomeric SMILES

C1CN(CCC1NCC2=NC3=CC=CC=C3O2)CC(CSC4=CC=CC=C4)O

InChI

InChI=1S/C22H27N3O2S/c26-18(16-28-19-6-2-1-3-7-19)15-25-12-10-17(11-13-25)23-14-22-24-20-8-4-5-9-21(20)27-22/h1-9,17-18,23,26H,10-16H2