N-(5-ethanoyl-4-phenyl-1,3-thiazol-2-yl)-1-pyrimidin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-(5-ethanoyl-4-phenyl-1,3-thiazol-2-yl)-1-pyrimidin-2-yl-piperidine-4-carboxamide Openeye Name: N-(5-acetyl-4-phenyl-thiazol-2-yl)-1-pyrimidin-2-yl-piperidine-4-carboxamide CAS Name: N-(5-acetyl-4-phenyl-2-thiazolyl)-1-(2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-(5-acetyl-4-phenyl-1,3-thiazol-2-yl)-1-pyrimidin-2-ylpiperidine-4-carboxamide Traditional Name: N-(5-acetyl-4-phenyl-thiazol-2-yl)-1-(2-pyrimidyl)isonipecotamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)C3=NC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=C(N=C(S1)NC(=O)C2CCN(CC2)C3=NC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5O2S/c1-14(27)18-17(15-6-3-2-4-7-15)24-21(29-18)25-19(28)16-8-12-26(13-9-16)20-22-10-5-11-23-20/h2-7,10-11,16H,8-9,12-13H2,1H3,(H,24,25,28)