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

Systemtic Name: 3-(3,4-dihydro-2H-thiochromen-8-yloxy)-1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one Openeye Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-thiochroman-8-yloxy-propan-1-one CAS Name: 3-(3,4-dihydro-2H-1-benzothiopyran-8-yloxy)-1-[4-(2-methoxyphenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(3,4-dihydro-2H-thiochromen-8-yloxy)-1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one Traditional Name: 1-[4-(2-methoxyphenyl)piperazino]-3-thiochroman-8-yloxy-propan-1-one Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CCOC3=CC=CC4=C3SCCC4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CCOC3=CC=CC4=C3SCCC4

InChI

InChI=1S/C23H28N2O3S/c1-27-20-9-3-2-8-19(20)24-12-14-25(15-13-24)22(26)11-16-28-21-10-4-6-18-7-5-17-29-23(18)21/h2-4,6,8-10H,5,7,11-17H2,1H3