tert-butyl 2-[4-[6-[(5-cyano-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]piperazin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[4-[6-[(5-cyano-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]piperazin-1-yl]ethanoate Openeye Name: tert-butyl 2-[4-[6-[(5-cyanothiazol-2-yl)amino]pyrimidin-4-yl]piperazin-1-yl]acetate CAS Name: 2-[4-[6-[(5-cyano-2-thiazolyl)amino]-4-pyrimidinyl]-1-piperazinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[6-[(5-cyano-1,3-thiazol-2-yl)amino]pyrimidin-4-yl]piperazin-1-yl]acetate Traditional Name: 2-[4-[6-[(5-cyanothiazol-2-yl)amino]pyrimidin-4-yl]piperazino]acetic acid tert-butyl ester Formula: C18H23N7O2S MolecularWeight: 401.48592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1CCN(CC1)C2=CC(=NC=N2)NC3=NC=C(S3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)CN1CCN(CC1)C2=CC(=NC=N2)NC3=NC=C(S3)C#N

InChI

InChI=1S/C18H23N7O2S/c1-18(2,3)27-16(26)11-24-4-6-25(7-5-24)15-8-14(21-12-22-15)23-17-20-10-13(9-19)28-17/h8,10,12H,4-7,11H2,1-3H3,(H,20,21,22,23)