4-[[[2-[(5-cyano-1,3-thiazol-2-yl)amino]pyridin-4-yl]methylamino]methyl]piperidine-1-carboxylic acid

Systemtic Name: 4-[[[2-[(5-cyano-1,3-thiazol-2-yl)amino]pyridin-4-yl]methylamino]methyl]piperidine-1-carboxylic acid Openeye Name: 4-[[[2-[(5-cyanothiazol-2-yl)amino]-4-pyridyl]methylamino]methyl]piperidine-1-carboxylic acid CAS Name: 4-[[[2-[(5-cyano-2-thiazolyl)amino]-4-pyridinyl]methylamino]methyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[[[2-[(5-cyano-1,3-thiazol-2-yl)amino]pyridin-4-yl]methylamino]methyl]piperidine-1-carboxylic acid Traditional Name: 4-[[[2-[(5-cyanothiazol-2-yl)amino]-4-pyridyl]methylamino]methyl]piperidine-1-carboxylic acid Formula: C17H20N6O2S MolecularWeight: 372.4447

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNCC2=CC(=NC=C2)NC3=NC=C(S3)C#N)C(=O)O

Isomeric SMILES

C1CN(CCC1CNCC2=CC(=NC=C2)NC3=NC=C(S3)C#N)C(=O)O

InChI

InChI=1S/C17H20N6O2S/c18-8-14-11-21-16(26-14)22-15-7-13(1-4-20-15)10-19-9-12-2-5-23(6-3-12)17(24)25/h1,4,7,11-12,19H,2-3,5-6,9-10H2,(H,24,25)(H,20,21,22)