ethyl 5-methyl-4-oxidanylidene-2-[(1R)-1-(pentylamino)ethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-2-[(1R)-1-(pentylamino)ethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-2-[(1R)-1-(pentylamino)ethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-[(1R)-1-(pentylamino)ethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-2-[(1R)-1-(pentylamino)ethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(1R)-1-(amylamino)ethyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(C)C1=NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)N1

Isomeric SMILES

CCCCCN[C@H](C)C1=NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)N1

InChI

InChI=1S/C17H25N3O3S/c1-5-7-8-9-18-11(4)14-19-15(21)12-10(3)13(17(22)23-6-2)24-16(12)20-14/h11,18H,5-9H2,1-4H3,(H,19,20,21)/t11-/m1/s1