6-[(2-chlorophenyl)methylsulfanyl]-7-cyano-4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-olate

Systemtic Name: 6-[(2-chlorophenyl)methylsulfanyl]-7-cyano-4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-olate Openeye Name: 6-[(2-chlorophenyl)methylsulfanyl]-7-cyano-4-oxo-1H-thieno[3,2-d]pyrimidin-2-olate CAS Name: 6-[(2-chlorophenyl)methylthio]-7-cyano-4-oxo-1H-thieno[3,2-d]pyrimidin-2-olate IUPAC Name: 6-[(2-chlorophenyl)methylsulfanyl]-7-cyano-4-oxo-1H-thieno[3,2-d]pyrimidin-2-olate Traditional Name: 6-[(2-chlorobenzyl)thio]-7-cyano-4-keto-1H-thieno[3,2-d]pyrimidin-2-olate Formula: C14H7ClN3O2S2- MolecularWeight: 348.80728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=C(C3=C(S2)C(=O)N=C(N3)[O-])C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=C(C3=C(S2)C(=O)N=C(N3)[O-])C#N)Cl

InChI

InChI=1S/C14H8ClN3O2S2/c15-9-4-2-1-3-7(9)6-21-13-8(5-16)10-11(22-13)12(19)18-14(20)17-10/h1-4H,6H2,(H2,17,18,19,20)/p-1