6-ethyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-ethyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-6-ethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 6-ethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylthio]-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 6-ethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-6-ethyl-2-[(4-keto-1H-quinazolin-2-yl)methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C20H18N4O2S2/c1-3-9-24-19(26)14-10-12(4-2)28-18(14)23-20(24)27-11-16-21-15-8-6-5-7-13(15)17(25)22-16/h3,5-8,10H,1,4,9,11H2,2H3,(H,21,22,25)