sodium 4-oxidanylidene-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2-thiolate

Systemtic Name: sodium 4-oxidanylidene-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2-thiolate Openeye Name: sodium 3-allyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine-2-thiolate CAS Name: sodium 4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2-thiolate IUPAC Name: sodium 4-oxo-3-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2-thiolate Traditional Name: sodium 3-allyl-4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine-2-thiolate Formula: C13H13N2NaOS2 MolecularWeight: 300.37489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1[S-])SC3=C2CCCC3.[Na+]

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1[S-])SC3=C2CCCC3.[Na+]

InChI

InChI=1S/C13H14N2OS2.Na/c1-2-7-15-12(16)10-8-5-3-4-6-9(8)18-11(10)14-13(15)17;/h2H,1,3-7H2,(H,14,17);/q;+1/p-1