N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-4-tert-butyl-benzamide

Systemtic Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-4-tert-butyl-benzamide Openeye Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-4-tert-butyl-benzamide CAS Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]phenyl]-4-tert-butylbenzamide IUPAC Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-4-tert-butylbenzamide Traditional Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]phenyl]-4-tert-butyl-benzamide Formula: C30H34N4OS MolecularWeight: 498.68216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CCN3CCN(CC3)C4=NSC5=CC=CC=C54

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)CCN3CCN(CC3)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C30H34N4OS/c1-30(2,3)24-12-10-23(11-13-24)29(35)31-25-14-8-22(9-15-25)16-17-33-18-20-34(21-19-33)28-26-6-4-5-7-27(26)36-32-28/h4-15H,16-21H2,1-3H3,(H,31,35)