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

Systemtic Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-2-methyl-benzamide CAS Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-2-methylbenzamide Traditional Name: N-[4-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]phenyl]-2-methyl-benzamide Formula: C27H28N4OS MolecularWeight: 456.60242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)CCN3CCN(CC3)C4=NSC5=CC=CC=C54

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)CCN3CCN(CC3)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C27H28N4OS/c1-20-6-2-3-7-23(20)27(32)28-22-12-10-21(11-13-22)14-15-30-16-18-31(19-17-30)26-24-8-4-5-9-25(24)33-29-26/h2-13H,14-19H2,1H3,(H,28,32)