2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-oxo-2-(1H-pyrrol-2-yl)ethyl]thio]-5-phenyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[[2-keto-2-(1H-pyrrol-2-yl)ethyl]thio]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=CN3)SC=C2C4=CC=CC=C4

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=CN3)SC=C2C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2S2/c1-2-11-24-20(26)18-15(14-7-4-3-5-8-14)12-27-19(18)23-21(24)28-13-17(25)16-9-6-10-22-16/h2-10,12,22H,1,11,13H2