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2-[3-(4-methoxyphenyl)propyl]-1-(phenylmethyl)sulfonyl-piperidine-2-carbothioate

2-[3-(4-methoxyphenyl)propyl]-1-(phenylmethyl)sulfonyl-piperidine-2-carbothioate

Systemtic Name:2-[3-(4-methoxyphenyl)propyl]-1-(phenylmethyl)sulfonyl-piperidine-2-carbothioate
Openeye Name:1-benzylsulfonyl-2-[3-(4-methoxyphenyl)propyl]piperidine-2-carbothioate
CAS Name:2-[3-(4-methoxyphenyl)propyl]-1-(phenylmethyl)sulfonyl-2-piperidinecarbothioate
IUPAC Name:1-benzylsulfonyl-2-[3-(4-methoxyphenyl)propyl]piperidine-2-carbothioate
Traditional Name:1-benzylsulfonyl-2-[3-(4-methoxyphenyl)propyl]thiopipecolinate
Formula: C23H28NO4S2-
MolecularWeight: 446.60272
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCC2(CCCCN2S(=O)(=O)CC3=CC=CC=C3)C(=S)[O-]


Isomeric SMILES

COC1=CC=C(C=C1)CCCC2(CCCCN2S(=O)(=O)CC3=CC=CC=C3)C(=S)[O-]


InChI

InChI=1S/C23H29NO4S2/c1-28-21-13-11-19(12-14-21)10-7-16-23(22(25)29)15-5-6-17-24(23)30(26,27)18-20-8-3-2-4-9-20/h2-4,8-9,11-14H,5-7,10,15-18H2,1H3,(H,25,29)/p-1


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