Protein Data Bank
in Europe

Bringing Structure to Biology

pdbe.org/chem

Download Links

Related compounds

Could not find any related compound in the PDB.

3D-Views

PDB Links

Molecule : 3MT

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C4H6NS/c1-5-2-3-6-4-5/h2-4H,1H3/q+1
2	InChIKey	InChI	1.03	PIDRHKDECUFWTG-UHFFFAOYSA-N
3	SMILES	ACDLabs	10.04	s1cc[n+](c1)C
4	SMILES	CACTVS	3.341	C[n+]1cscc1
5	SMILES	OpenEye OEToolkits	1.5.0	C[n+]1ccsc1
6	Canonical SMILES	CACTVS	3.341	C[n+]1cscc1
7	Canonical SMILES	OpenEye OEToolkits	1.5.0	C[n+]1ccsc1