ethyl 4-[[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-[[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-[[1-(2-amino-2-oxo-ethyl)-4-piperidyl]amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[[1-(2-amino-2-oxoethyl)-4-piperidinyl]amino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(2-amino-2-oxoethyl)piperidin-4-yl]amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-[[1-(2-amino-2-keto-ethyl)-4-piperidyl]amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H23N5O3S MolecularWeight: 377.46122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC3CCN(CC3)CC(=O)N)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)NC3CCN(CC3)CC(=O)N)C

InChI

InChI=1S/C17H23N5O3S/c1-3-25-17(24)14-10(2)13-15(19-9-20-16(13)26-14)21-11-4-6-22(7-5-11)8-12(18)23/h9,11H,3-8H2,1-2H3,(H2,18,23)(H,19,20,21)