1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(phenylmethylsulfanyl)propan-1-one

Systemtic Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-(phenylmethylsulfanyl)propan-1-one Openeye Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidyl]-2-benzylsulfanyl-propan-1-one CAS Name: 1-[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-2-(phenylmethylthio)-1-propanone IUPAC Name: 1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-benzylsulfanylpropan-1-one Traditional Name: 1-[4-(1,3-benzoxazol-2-yl)piperidino]-2-(benzylthio)propan-1-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C2=NC3=CC=CC=C3O2)SCC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCC(CC1)C2=NC3=CC=CC=C3O2)SCC4=CC=CC=C4

InChI

InChI=1S/C22H24N2O2S/c1-16(27-15-17-7-3-2-4-8-17)22(25)24-13-11-18(12-14-24)21-23-19-9-5-6-10-20(19)26-21/h2-10,16,18H,11-15H2,1H3