2-(3-cyano-4-piperidin-1-yl-phenyl)-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-(3-cyano-4-piperidin-1-yl-phenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[3-cyano-4-(1-piperidyl)phenyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[3-cyano-4-(1-piperidinyl)phenyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-(3-cyano-4-piperidin-1-ylphenyl)-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(3-cyano-4-piperidino-phenyl)-4-methyl-thiazole-5-carboxylic acid Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC(=C(C=C2)N3CCCCC3)C#N)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)C2=CC(=C(C=C2)N3CCCCC3)C#N)C(=O)O

InChI

InChI=1S/C17H17N3O2S/c1-11-15(17(21)22)23-16(19-11)12-5-6-14(13(9-12)10-18)20-7-3-2-4-8-20/h5-6,9H,2-4,7-8H2,1H3,(H,21,22)