N-[(2S,3R)-1-azanyl-3-oxidanyl-1-oxidanylidene-butan-2-yl]-6-[2-(4-propan-2-ylphenyl)-5-pyridin-2-yl-pyrazol-3-yl]hexanamide

Systemtic Name: N-[(2S,3R)-1-azanyl-3-oxidanyl-1-oxidanylidene-butan-2-yl]-6-[2-(4-propan-2-ylphenyl)-5-pyridin-2-yl-pyrazol-3-yl]hexanamide Openeye Name: N-[(1S,2R)-1-carbamoyl-2-hydroxy-propyl]-6-[2-(4-isopropylphenyl)-5-(2-pyridyl)pyrazol-3-yl]hexanamide CAS Name: N-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-6-[2-(4-propan-2-ylphenyl)-5-(2-pyridinyl)-3-pyrazolyl]hexanamide IUPAC Name: N-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-6-[2-(4-propan-2-ylphenyl)-5-pyridin-2-ylpyrazol-3-yl]hexanamide Traditional Name: N-[(1S,2R)-1-carbamoyl-2-hydroxy-propyl]-6-[2-p-cumenyl-5-(2-pyridyl)pyrazol-3-yl]hexanamide Formula: C27H35N5O3 MolecularWeight: 477.5985

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CC=N3)CCCCCC(=O)NC(C(C)O)C(=O)N

Isomeric SMILES

C[C@H]([C@@H](C(=O)N)NC(=O)CCCCCC1=CC(=NN1C2=CC=C(C=C2)C(C)C)C3=CC=CC=N3)O

InChI

InChI=1S/C27H35N5O3/c1-18(2)20-12-14-21(15-13-20)32-22(17-24(31-32)23-10-7-8-16-29-23)9-5-4-6-11-25(34)30-26(19(3)33)27(28)35/h7-8,10,12-19,26,33H,4-6,9,11H2,1-3H3,(H2,28,35)(H,30,34)/t19-,26+/m1/s1