4-(3,4-dihydro-2H-thiochromen-8-yloxy)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one

Systemtic Name: 4-(3,4-dihydro-2H-thiochromen-8-yloxy)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one Openeye Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-4-thiochroman-8-yloxy-butan-1-one CAS Name: 4-(3,4-dihydro-2H-1-benzothiopyran-8-yloxy)-1-[4-(2-methoxyphenyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(3,4-dihydro-2H-thiochromen-8-yloxy)-1-[4-(2-methoxyphenyl)piperazin-1-yl]butan-1-one Traditional Name: 1-[4-(2-methoxyphenyl)piperazino]-4-thiochroman-8-yloxy-butan-1-one Formula: C24H30N2O3S MolecularWeight: 426.5716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CCCOC3=CC=CC4=C3SCCC4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CCCOC3=CC=CC4=C3SCCC4

InChI

InChI=1S/C24H30N2O3S/c1-28-21-10-3-2-9-20(21)25-13-15-26(16-14-25)23(27)12-5-17-29-22-11-4-7-19-8-6-18-30-24(19)22/h2-4,7,9-11H,5-6,8,12-18H2,1H3