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

Systemtic Name: prop-2-enyl 5-methyl-2-[(2-methylpropylamino)methyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[(isobutylamino)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-[(2-methylpropylamino)methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 5-methyl-2-[(2-methylpropylamino)methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(isobutylamino)methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O3S/c1-5-6-22-16(21)13-10(4)12-14(20)18-11(19-15(12)23-13)8-17-7-9(2)3/h5,9,17H,1,6-8H2,2-4H3,(H,18,19,20)