[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-[4-(2-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-[4-(2-methoxyphenyl)piperazino]methanone Formula: C26H25N3O2S2 MolecularWeight: 475.6256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H25N3O2S2/c1-31-23-8-4-3-7-22(23)28-14-16-29(17-15-28)25(30)20-12-10-19(11-13-20)18-32-26-27-21-6-2-5-9-24(21)33-26/h2-13H,14-18H2,1H3