tert-butyl 4-[[[6-[(5-cyano-1,3-thiazol-2-yl)amino]-2-methyl-pyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[[6-[(5-cyano-1,3-thiazol-2-yl)amino]-2-methyl-pyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[[6-[(5-cyanothiazol-2-yl)amino]-2-methyl-pyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate CAS Name: 4-[[[6-[(5-cyano-2-thiazolyl)amino]-2-methyl-4-pyrimidinyl]amino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[[6-[(5-cyano-1,3-thiazol-2-yl)amino]-2-methylpyrimidin-4-yl]amino]methyl]piperidine-1-carboxylate Traditional Name: 4-[[[6-[(5-cyanothiazol-2-yl)amino]-2-methyl-pyrimidin-4-yl]amino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H27N7O2S MolecularWeight: 429.53908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NCC2CCN(CC2)C(=O)OC(C)(C)C)NC3=NC=C(S3)C#N

Isomeric SMILES

CC1=NC(=CC(=N1)NCC2CCN(CC2)C(=O)OC(C)(C)C)NC3=NC=C(S3)C#N

InChI

InChI=1S/C20H27N7O2S/c1-13-24-16(9-17(25-13)26-18-23-12-15(10-21)30-18)22-11-14-5-7-27(8-6-14)19(28)29-20(2,3)4/h9,12,14H,5-8,11H2,1-4H3,(H2,22,23,24,25,26)