N-(4-oxidanylidene-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-(4-oxidanylidene-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(4-oxo-6-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(4-oxo-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-(4-oxo-6-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: 2-(benzylthio)-N-(4-keto-6-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C21H17N3O2S3 MolecularWeight: 439.57358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(=O)NN2C(=O)C3=C(NC2=S)SC(=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSCC(=O)NN2C(=O)C3=C(NC2=S)SC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2S3/c25-18(13-28-12-14-7-3-1-4-8-14)23-24-20(26)16-11-17(15-9-5-2-6-10-15)29-19(16)22-21(24)27/h1-11H,12-13H2,(H,22,27)(H,23,25)