4-ethyl-5-(1-oxidanidylpyridin-1-ium-3-yl)imino-2-propyl-1,2,4-thiadiazolidin-3-one

Systemtic Name: 4-ethyl-5-(1-oxidanidylpyridin-1-ium-3-yl)imino-2-propyl-1,2,4-thiadiazolidin-3-one Openeye Name: 4-ethyl-5-(1-oxidopyridin-1-ium-3-yl)imino-2-propyl-1,2,4-thiadiazolidin-3-one CAS Name: 4-ethyl-5-[(1-oxido-3-pyridin-1-iumyl)imino]-2-propyl-1,2,4-thiadiazolidin-3-one IUPAC Name: 4-ethyl-5-(1-oxidopyridin-1-ium-3-yl)imino-2-propyl-1,2,4-thiadiazolidin-3-one Traditional Name: 4-ethyl-5-(1-oxidopyridin-1-ium-3-yl)imino-2-propyl-1,2,4-thiadiazolidin-3-one Formula: C12H16N4O2S MolecularWeight: 280.34604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)N(C(=NC2=C[N+](=CC=C2)[O-])S1)CC

Isomeric SMILES

CCCN1C(=O)N(C(=NC2=C[N+](=CC=C2)[O-])S1)CC

InChI

InChI=1S/C12H16N4O2S/c1-3-7-16-12(17)15(4-2)11(19-16)13-10-6-5-8-14(18)9-10/h5-6,8-9H,3-4,7H2,1-2H3