[2-(4-phenylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 4-(phenylcarbonyl)benzoate

Systemtic Name: [2-(4-phenylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 4-(phenylcarbonyl)benzoate Openeye Name: [2-(4-phenylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 4-benzoylbenzoate CAS Name: 4-benzoylbenzoic acid [2-(4-phenyl-1-piperazinyl)-1,3-benzothiazol-6-yl] ester IUPAC Name: [2-(4-phenylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 4-benzoylbenzoate Traditional Name: 4-benzoylbenzoic acid [2-(4-phenylpiperazino)-1,3-benzothiazol-6-yl] ester Formula: C31H25N3O3S MolecularWeight: 519.6135

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)OC(=O)C5=CC=C(C=C5)C(=O)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)OC(=O)C5=CC=C(C=C5)C(=O)C6=CC=CC=C6

InChI

InChI=1S/C31H25N3O3S/c35-29(22-7-3-1-4-8-22)23-11-13-24(14-12-23)30(36)37-26-15-16-27-28(21-26)38-31(32-27)34-19-17-33(18-20-34)25-9-5-2-6-10-25/h1-16,21H,17-20H2