N-ethyl-N-[[1-[2-(3-fluorophenyl)ethyl]piperidin-3-yl]methyl]-1,4-dithiepan-6-amine

Systemtic Name: N-ethyl-N-[[1-[2-(3-fluorophenyl)ethyl]piperidin-3-yl]methyl]-1,4-dithiepan-6-amine Openeye Name: N-ethyl-N-[[1-[2-(3-fluorophenyl)ethyl]-3-piperidyl]methyl]-1,4-dithiepan-6-amine CAS Name: N-ethyl-N-[[1-[2-(3-fluorophenyl)ethyl]-3-piperidinyl]methyl]-1,4-dithiepan-6-amine IUPAC Name: N-ethyl-N-[[1-[2-(3-fluorophenyl)ethyl]piperidin-3-yl]methyl]-1,4-dithiepan-6-amine Traditional Name: 1,4-dithiepan-6-yl-ethyl-[[1-[2-(3-fluorophenyl)ethyl]-3-piperidyl]methyl]amine Formula: C21H33FN2S2 MolecularWeight: 396.628523

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CCCN(C1)CCC2=CC(=CC=C2)F)C3CSCCSC3

Isomeric SMILES

CCN(CC1CCCN(C1)CCC2=CC(=CC=C2)F)C3CSCCSC3

InChI

InChI=1S/C21H33FN2S2/c1-2-24(21-16-25-11-12-26-17-21)15-19-6-4-9-23(14-19)10-8-18-5-3-7-20(22)13-18/h3,5,7,13,19,21H,2,4,6,8-12,14-17H2,1H3