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

Systemtic Name: 3-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-oxo-ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-oxoethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(2,5-dimethyl-1-propylpyrrol-3-yl)-2-oxoethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-2-keto-ethyl]thieno[2,3-d]pyrimidin-4-one Formula: C17H19N3O2S MolecularWeight: 329.41666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)CN2C=NC3=C(C2=O)C=CS3)C

Isomeric SMILES

CCCN1C(=CC(=C1C)C(=O)CN2C=NC3=C(C2=O)C=CS3)C

InChI

InChI=1S/C17H19N3O2S/c1-4-6-20-11(2)8-14(12(20)3)15(21)9-19-10-18-16-13(17(19)22)5-7-23-16/h5,7-8,10H,4,6,9H2,1-3H3