N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[2-(4-dimethylaminophenyl)-2-(4-phenyl-1-piperazinyl)ethyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-yl)ethyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-[2-(4-dimethylaminophenyl)-2-(4-phenylpiperazino)ethyl]-1,3-benzothiazole-2-carboxamide Formula: C28H31N5OS MolecularWeight: 485.64364

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=NC3=CC=CC=C3S2)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2=NC3=CC=CC=C3S2)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H31N5OS/c1-31(2)22-14-12-21(13-15-22)25(33-18-16-32(17-19-33)23-8-4-3-5-9-23)20-29-27(34)28-30-24-10-6-7-11-26(24)35-28/h3-15,25H,16-20H2,1-2H3,(H,29,34)