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

Systemtic Name: tert-butyl 4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-3-(phenylmethyl)piperazine-1-carboxylate Openeye Name: tert-butyl 3-benzyl-4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-3-(phenylmethyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-benzyl-4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 3-benzyl-4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3CC4=CC=CC=C4)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3CC4=CC=CC=C4)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H30N4O2S/c1-5-19-14-20-21(25-16-26-22(20)31-19)28-12-11-27(23(29)30-24(2,3)4)15-18(28)13-17-9-7-6-8-10-17/h6-10,14,16,18H,5,11-13,15H2,1-4H3