Summary

IMPPAT Phytochemical identifier: IMPHY015553

Phytochemical name: Cheirolin

Synonymous chemical names:
cheirolin, cheiroline

External chemical identifiers:
CID:10454, ZINC:ZINC000002040415, FDASRS:8DA547512J, SureChEMBL:SCHEMBL1688838

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Chemical structure information

SMILES:
S=C=NCCCS(=O)(=O)C

InChI:
InChI=1S/C5H9NO2S2/c1-10(7,8)4-2-3-6-5-9/h2-4H2,1H3

InChIKey:
ZSJGCHNCYSHQEU-UHFFFAOYSA-N

DeepSMILES:
S=C=NCCCS=O)=O)C

Functional groups:
CN=C=S, CS(C)(=O)=O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organosulfur compounds

ClassyFire Class: Sulfonyls

ClassyFire Subclass: Sulfones

NP-Likeness score: -0.182

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Chemical structure download