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

Systemtic Name: 3-[2-(2,5-dimethyl-1H-pyrrol-3-yl)-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(2,5-dimethyl-1H-pyrrol-3-yl)-2-oxo-ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(2,5-dimethyl-1H-pyrrol-3-yl)-2-oxoethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(2,5-dimethyl-1H-pyrrol-3-yl)-2-oxoethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(2,5-dimethyl-1H-pyrrol-3-yl)-2-keto-ethyl]thieno[2,3-d]pyrimidin-4-one Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C)C(=O)CN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

CC1=CC(=C(N1)C)C(=O)CN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C14H13N3O2S/c1-8-5-11(9(2)16-8)12(18)6-17-7-15-13-10(14(17)19)3-4-20-13/h3-5,7,16H,6H2,1-2H3