3,4-dihydrodibenzothiophen-2-yl-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: 3,4-dihydrodibenzothiophen-2-yl-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanone Openeye Name: 3,4-dihydrodibenzothiophen-2-yl-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanone CAS Name: 3,4-dihydrodibenzothiophen-2-yl-[4-[(3,4,5-trimethoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: 3,4-dihydrodibenzothiophen-2-yl-[4-[(3,4,5-trimethoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: 3,4-dihydrodibenzothiophen-2-yl-[4-(3,4,5-trimethoxybenzyl)piperazino]methanone Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN2CCN(CC2)C(=O)C3=CC4=C(CC3)SC5=CC=CC=C54

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN2CCN(CC2)C(=O)C3=CC4=C(CC3)SC5=CC=CC=C54

InChI

InChI=1S/C27H30N2O4S/c1-31-22-14-18(15-23(32-2)26(22)33-3)17-28-10-12-29(13-11-28)27(30)19-8-9-25-21(16-19)20-6-4-5-7-24(20)34-25/h4-7,14-16H,8-13,17H2,1-3H3