prop-2-enyl 5-methyl-4-oxidanylidene-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: prop-2-enyl 5-methyl-4-oxidanylidene-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 5-methyl-4-oxo-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-(1-pyrrolidinylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 5-methyl-4-oxo-2-(pyrrolidin-1-ylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-(pyrrolidinomethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCCC3)C(=O)OCC=C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN3CCCC3)C(=O)OCC=C

InChI

InChI=1S/C16H19N3O3S/c1-3-8-22-16(21)13-10(2)12-14(20)17-11(18-15(12)23-13)9-19-6-4-5-7-19/h3H,1,4-9H2,2H3,(H,17,18,20)