2-[4-(1,4-dithiepan-6-yl)-1-[(3-methoxyphenyl)methyl]piperazin-2-yl]ethanol

Systemtic Name: 2-[4-(1,4-dithiepan-6-yl)-1-[(3-methoxyphenyl)methyl]piperazin-2-yl]ethanol Openeye Name: 2-[4-(1,4-dithiepan-6-yl)-1-[(3-methoxyphenyl)methyl]piperazin-2-yl]ethanol CAS Name: 2-[4-(1,4-dithiepan-6-yl)-1-[(3-methoxyphenyl)methyl]-2-piperazinyl]ethanol IUPAC Name: 2-[4-(1,4-dithiepan-6-yl)-1-[(3-methoxyphenyl)methyl]piperazin-2-yl]ethanol Traditional Name: 2-[4-(1,4-dithiepan-6-yl)-1-m-anisyl-piperazin-2-yl]ethanol Formula: C19H30N2O2S2 MolecularWeight: 382.5837

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCN(CC2CCO)C3CSCCSC3

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCN(CC2CCO)C3CSCCSC3

InChI

InChI=1S/C19H30N2O2S2/c1-23-19-4-2-3-16(11-19)12-20-6-7-21(13-17(20)5-8-22)18-14-24-9-10-25-15-18/h2-4,11,17-18,22H,5-10,12-15H2,1H3