8-methoxy-2-[4-(4-phenylpiperazin-1-yl)butyl]-4,5-dihydrobenzo[e][1,3]benzothiazole

Systemtic Name: 8-methoxy-2-[4-(4-phenylpiperazin-1-yl)butyl]-4,5-dihydrobenzo[e][1,3]benzothiazole Openeye Name: 8-methoxy-2-[4-(4-phenylpiperazin-1-yl)butyl]-4,5-dihydrobenzo[e][1,3]benzothiazole CAS Name: 8-methoxy-2-[4-(4-phenyl-1-piperazinyl)butyl]-4,5-dihydrobenzo[e][1,3]benzothiazole IUPAC Name: 8-methoxy-2-[4-(4-phenylpiperazin-1-yl)butyl]-4,5-dihydrobenzo[e][1,3]benzothiazole Traditional Name: 8-methoxy-2-[4-(4-phenylpiperazino)butyl]-4,5-dihydrobenzo[e][1,3]benzothiazole Formula: C26H31N3OS MolecularWeight: 433.60884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CCC3=C2N=C(S3)CCCCN4CCN(CC4)C5=CC=CC=C5)C=C1

Isomeric SMILES

COC1=CC2=C(CCC3=C2N=C(S3)CCCCN4CCN(CC4)C5=CC=CC=C5)C=C1

InChI

InChI=1S/C26H31N3OS/c1-30-22-12-10-20-11-13-24-26(23(20)19-22)27-25(31-24)9-5-6-14-28-15-17-29(18-16-28)21-7-3-2-4-8-21/h2-4,7-8,10,12,19H,5-6,9,11,13-18H2,1H3