tert-butyl 4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxylate

Systemtic Name: tert-butyl 4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxylate Openeye Name: tert-butyl 4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxylate CAS Name: 4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxylate Traditional Name: 4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-1,4-diazepane-1-carboxylic acid tert-butyl ester Formula: C18H26N4O2S MolecularWeight: 362.48964

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H26N4O2S/c1-5-13-11-14-15(19-12-20-16(14)25-13)21-7-6-8-22(10-9-21)17(23)24-18(2,3)4/h11-12H,5-10H2,1-4H3