1-[4-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-methoxy-butoxy]-3-methoxy-phenyl]ethanone

Systemtic Name: 1-[4-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-methoxy-butoxy]-3-methoxy-phenyl]ethanone Openeye Name: 1-[4-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-methoxy-butoxy]-3-methoxy-phenyl]ethanone CAS Name: 1-[4-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-3-methoxybutoxy]-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-methoxybutoxy]-3-methoxyphenyl]ethanone Traditional Name: 1-[4-[4-[4-(1,2-benzothiazol-3-yl)piperazino]-3-methoxy-butoxy]-3-methoxy-phenyl]ethanone Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCCC(CN2CCN(CC2)C3=NSC4=CC=CC=C43)OC)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCCC(CN2CCN(CC2)C3=NSC4=CC=CC=C43)OC)OC

InChI

InChI=1S/C25H31N3O4S/c1-18(29)19-8-9-22(23(16-19)31-3)32-15-10-20(30-2)17-27-11-13-28(14-12-27)25-21-6-4-5-7-24(21)33-26-25/h4-9,16,20H,10-15,17H2,1-3H3