3-(4-methyl-1,3-thiazol-5-yl)-1-[(3S)-3-(5-phenyl-2-pyridin-4-yl-pyrimidin-4-yl)piperidin-1-yl]propan-1-one

Systemtic Name: 3-(4-methyl-1,3-thiazol-5-yl)-1-[(3S)-3-(5-phenyl-2-pyridin-4-yl-pyrimidin-4-yl)piperidin-1-yl]propan-1-one Openeye Name: 3-(4-methylthiazol-5-yl)-1-[(3S)-3-[5-phenyl-2-(4-pyridyl)pyrimidin-4-yl]-1-piperidyl]propan-1-one CAS Name: 3-(4-methyl-5-thiazolyl)-1-[(3S)-3-(5-phenyl-2-pyridin-4-yl-4-pyrimidinyl)-1-piperidinyl]-1-propanone IUPAC Name: 3-(4-methyl-1,3-thiazol-5-yl)-1-[(3S)-3-(5-phenyl-2-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]propan-1-one Traditional Name: 3-(4-methylthiazol-5-yl)-1-[(3S)-3-[5-phenyl-2-(4-pyridyl)pyrimidin-4-yl]piperidino]propan-1-one Formula: C27H27N5OS MolecularWeight: 469.60118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=N1)CCC(=O)N2CCCC(C2)C3=NC(=NC=C3C4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

CC1=C(SC=N1)CCC(=O)N2CCC[C@@H](C2)C3=NC(=NC=C3C4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C27H27N5OS/c1-19-24(34-18-30-19)9-10-25(33)32-15-5-8-22(17-32)26-23(20-6-3-2-4-7-20)16-29-27(31-26)21-11-13-28-14-12-21/h2-4,6-7,11-14,16,18,22H,5,8-10,15,17H2,1H3/t22-/m0/s1