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

Systemtic Name: [4-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[[4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-oxomethyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[4-[(1,3-benzothiazol-2-ylthio)methyl]benzoyl]piperazino]-phenyl-methanone Formula: C26H23N3O2S2 MolecularWeight: 473.60972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H23N3O2S2/c30-24(20-6-2-1-3-7-20)28-14-16-29(17-15-28)25(31)21-12-10-19(11-13-21)18-32-26-27-22-8-4-5-9-23(22)33-26/h1-13H,14-18H2