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

Systemtic Name: [2-(4-phenylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 4-phenylbenzoate Openeye Name: [2-(4-phenylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 4-phenylbenzoate CAS Name: 4-phenylbenzoic 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-phenylbenzoate Traditional Name: 4-phenylbenzoic acid [2-(4-phenylpiperazino)-1,3-benzothiazol-6-yl] ester Formula: C30H25N3O2S MolecularWeight: 491.6034

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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)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)C6=CC=CC=C6

InChI

InChI=1S/C30H25N3O2S/c34-29(24-13-11-23(12-14-24)22-7-3-1-4-8-22)35-26-15-16-27-28(21-26)36-30(31-27)33-19-17-32(18-20-33)25-9-5-2-6-10-25/h1-16,21H,17-20H2