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

Systemtic Name: N-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-methoxy-benzamide Openeye Name: N-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-methoxy-benzamide CAS Name: N-[3-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]phenyl]-3-methoxybenzamide IUPAC Name: N-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-methoxybenzamide Traditional Name: N-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]phenyl]-3-methoxy-benzamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=CC=CC(=C2)CCN3CCN(CC3)C4=NSC5=CC=CC=C54

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=CC=CC(=C2)CCN3CCN(CC3)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C27H28N4O2S/c1-33-23-9-5-7-21(19-23)27(32)28-22-8-4-6-20(18-22)12-13-30-14-16-31(17-15-30)26-24-10-2-3-11-25(24)34-29-26/h2-11,18-19H,12-17H2,1H3,(H,28,32)