Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID018040

Phytochemical name: Thieno[2,3-c]pyridine

Synonymous chemical names:
Thieno[2,3-c]pyridine

External chemical identifiers:
CID:CID_9224, FDASRS:C2A49UZQ9T, Molport-003-844-366

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Chemical structure information

SMILES:
c1ncc2c(c1)ccs2

InChI:
InChI=1S/C7H5NS/c1-3-8-5-7-6(1)2-4-9-7/h1-5H

InChIKey:
GDQBPBMIAFIRIU-UHFFFAOYSA-N

DeepSMILES:
cncccc6)ccs5

Functional groups:
csc, cnc

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
c1cc2ccsc2cn1

Scaffold Graph/Node level:
C1CC2CCSC2CN1

Scaffold Graph level:
C1CCC2CCCC2C1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Thienopyridines

NP Classifier Biosynthetic pathway: Alkaloids

NP Classifier Superclass: Nicotinic acid alkaloids

NP Classifier Class: Pyridine alkaloids

NP-Likeness score: -1.721

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Chemical structure download