2-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(7-ethyl-2-oxo-chromen-4-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(7-ethyl-2-oxo-1-benzopyran-4-yl)methylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(7-ethyl-2-oxochromen-4-yl)methylsulfanyl]-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(7-ethyl-2-keto-chromen-4-yl)methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C21H18N2O3S2 MolecularWeight: 410.50922

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C=CS4)C(=O)N3CC=C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C=CS4)C(=O)N3CC=C

InChI

InChI=1S/C21H18N2O3S2/c1-3-8-23-20(25)16-7-9-27-19(16)22-21(23)28-12-14-11-18(24)26-17-10-13(4-2)5-6-15(14)17/h3,5-7,9-11H,1,4,8,12H2,2H3