tert-butyl 4-(2-aminocarbonyl-6-ethyl-thieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-aminocarbonyl-6-ethyl-thieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-carbamoyl-6-ethyl-thieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-(2-carbamoyl-6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-carbamoyl-6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(2-carbamoyl-6-ethyl-thieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C18H25N5O3S MolecularWeight: 391.4878

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=C(N=C2S1)C(=O)N)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CC2=C(N=C(N=C2S1)C(=O)N)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H25N5O3S/c1-5-11-10-12-15(20-14(13(19)24)21-16(12)27-11)22-6-8-23(9-7-22)17(25)26-18(2,3)4/h10H,5-9H2,1-4H3,(H2,19,24)