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

Systemtic Name: 4-[[2-[(5-cyano-1,3-thiazol-2-yl)amino]pyridin-4-yl]methyl]piperazine-1-carboxylic acid Openeye Name: 4-[[2-[(5-cyanothiazol-2-yl)amino]-4-pyridyl]methyl]piperazine-1-carboxylic acid CAS Name: 4-[[2-[(5-cyano-2-thiazolyl)amino]-4-pyridinyl]methyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[[2-[(5-cyano-1,3-thiazol-2-yl)amino]pyridin-4-yl]methyl]piperazine-1-carboxylic acid Traditional Name: 4-[[2-[(5-cyanothiazol-2-yl)amino]-4-pyridyl]methyl]piperazine-1-carboxylic acid Formula: C15H16N6O2S MolecularWeight: 344.39154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=NC=C2)NC3=NC=C(S3)C#N)C(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC(=NC=C2)NC3=NC=C(S3)C#N)C(=O)O

InChI

InChI=1S/C15H16N6O2S/c16-8-12-9-18-14(24-12)19-13-7-11(1-2-17-13)10-20-3-5-21(6-4-20)15(22)23/h1-2,7,9H,3-6,10H2,(H,22,23)(H,17,18,19)