Summary

IMPPAT Phytochemical identifier: IMPHY009381

Phytochemical name: 1,2-Dimercaptocyclopentane

Synonymous chemical names:
1,2-dimercaptocyclopentane

External chemical identifiers:
CID:12371414, SureChEMBL:SCHEMBL62317

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Chemical structure information

SMILES:
SC1CCCC1S

InChI:
InChI=1S/C5H10S2/c6-4-2-1-3-5(4)7/h4-7H,1-3H2

InChIKey:
YZVNURZNMBCWGG-UHFFFAOYSA-N

DeepSMILES:
SCCCCC5S

Functional groups:
CS

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1CCCC1

Scaffold Graph/Node level:
C1CCCC1

Scaffold Graph level:
C1CCCC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organosulfur compounds

ClassyFire Class: Thiols

ClassyFire Subclass: Alkylthiols

NP-Likeness score: 0.295

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Chemical structure download