2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(7-methyl-2-oxochromen-4-yl)methylsulfanyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(2-keto-7-methyl-chromen-4-yl)methylthio]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H14N2O3S3 MolecularWeight: 438.54246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3

InChI

InChI=1S/C21H14N2O3S3/c1-11-4-5-13-12(8-17(24)26-15(13)7-11)9-29-21-22-19(25)18-14(10-28-20(18)23-21)16-3-2-6-27-16/h2-8,10H,9H2,1H3,(H,22,23,25)