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

Systemtic Name: 4-[[2-[(5-phenyl-1,3-thiazol-2-yl)amino]pyridin-4-yl]methyl]piperazine-1-carboxylic acid Openeye Name: 4-[[2-[(5-phenylthiazol-2-yl)amino]-4-pyridyl]methyl]piperazine-1-carboxylic acid CAS Name: 4-[[2-[(5-phenyl-2-thiazolyl)amino]-4-pyridinyl]methyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[[2-[(5-phenyl-1,3-thiazol-2-yl)amino]pyridin-4-yl]methyl]piperazine-1-carboxylic acid Traditional Name: 4-[[2-[(5-phenylthiazol-2-yl)amino]-4-pyridyl]methyl]piperazine-1-carboxylic acid Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=NC=C2)NC3=NC=C(S3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CN(CCN1CC2=CC(=NC=C2)NC3=NC=C(S3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C20H21N5O2S/c26-20(27)25-10-8-24(9-11-25)14-15-6-7-21-18(12-15)23-19-22-13-17(28-19)16-4-2-1-3-5-16/h1-7,12-13H,8-11,14H2,(H,26,27)(H,21,22,23)