5,6-dimethyl-2-[(3Z)-3-methylsulfanyl-2-oxidanylidene-hexa-3,5-dienyl]sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(3Z)-3-methylsulfanyl-2-oxidanylidene-hexa-3,5-dienyl]sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5,6-dimethyl-2-[(3Z)-3-methylsulfanyl-2-oxo-hexa-3,5-dienyl]sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5,6-dimethyl-2-[[(3Z)-3-(methylthio)-2-oxohexa-3,5-dienyl]thio]-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5,6-dimethyl-2-[(3Z)-3-methylsulfanyl-2-oxohexa-3,5-dienyl]sulfanyl-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(3Z)-2-keto-3-(methylthio)hexa-3,5-dienyl]thio]-5,6-dimethyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H20N2O2S3 MolecularWeight: 428.5907

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)C(=CC=C)SC)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)/C(=C/C=C)/SC)C3=CC=CC=C3)C

InChI

InChI=1S/C21H20N2O2S3/c1-5-9-17(26-4)16(24)12-27-21-22-19-18(13(2)14(3)28-19)20(25)23(21)15-10-7-6-8-11-15/h5-11H,1,12H2,2-4H3/b17-9-