[2-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]-[4-(2-methylphenyl)piperazin-1-yl]methanone

Systemtic Name: [2-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]-[4-(2-methylphenyl)piperazin-1-yl]methanone Openeye Name: [2-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]-[4-(o-tolyl)piperazin-1-yl]methanone CAS Name: [2-[(1,3-benzoxazol-2-ylthio)methyl]phenyl]-[4-(2-methylphenyl)-1-piperazinyl]methanone IUPAC Name: [2-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]-[4-(2-methylphenyl)piperazin-1-yl]methanone Traditional Name: [2-[(1,3-benzoxazol-2-ylthio)methyl]phenyl]-[4-(o-tolyl)piperazino]methanone Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5O4

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C26H25N3O2S/c1-19-8-2-6-12-23(19)28-14-16-29(17-15-28)25(30)21-10-4-3-9-20(21)18-32-26-27-22-11-5-7-13-24(22)31-26/h2-13H,14-18H2,1H3