Summary

IMPPAT Phytochemical identifier: IMPHY004881

Phytochemical name: 2-Oxazolidinethione, 5-ethyl-5-methyl-, (S)-

Synonymous chemical names:
2-oxazolidinethione, 5-ethyl-5-methyl-, (s)-, cleomin

External chemical identifiers:
CID:5315964

---

Chemical structure information

SMILES:
C[C@]1(CC)CNC(=S)O1

InChI:
InChI=1S/C6H11NOS/c1-3-6(2)4-7-5(9)8-6/h3-4H2,1-2H3,(H,7,9)/t6-/m0/s1

InChIKey:
GMDUYWRBDHXKMS-LURJTMIESA-N

DeepSMILES:
C[C@]CC))CNC=S)O5

Functional groups:
S=C1NCCO1

---

Molecular scaffolds

Scaffold Graph/Node/Bond level:
S=C1NCCO1

Scaffold Graph/Node level:
SC1NCCO1

Scaffold Graph level:
CC1CCCC1

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organoheterocyclic compounds

ClassyFire Class: Azolidines

ClassyFire Subclass: Oxazolidines

NP Classifier Biosynthetic pathway: Alkaloids

NP-Likeness score: 1.535

---

Chemical structure download