N-[(2R)-3-methyl-1-oxidanylidene-1-[[4-(pyrazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[(2R)-3-methyl-1-oxidanylidene-1-[[4-(pyrazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]cyclohexanecarboxamide Openeye Name: N-[(1R)-2-methyl-1-[[4-(pyrazol-1-ylmethyl)phenyl]methylcarbamoyl]propyl]cyclohexanecarboxamide CAS Name: N-[(2R)-3-methyl-1-oxo-1-[[4-(1-pyrazolylmethyl)phenyl]methylamino]butan-2-yl]cyclohexanecarboxamide IUPAC Name: N-[(2R)-3-methyl-1-oxo-1-[[4-(pyrazol-1-ylmethyl)phenyl]methylamino]butan-2-yl]cyclohexanecarboxamide Traditional Name: N-[(1R)-2-methyl-1-[[4-(pyrazol-1-ylmethyl)benzyl]carbamoyl]propyl]cyclohexanecarboxamide Formula: C23H32N4O2 MolecularWeight: 396.52578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=C(C=C1)CN2C=CC=N2)NC(=O)C3CCCCC3

Isomeric SMILES

CC(C)[C@H](C(=O)NCC1=CC=C(C=C1)CN2C=CC=N2)NC(=O)C3CCCCC3

InChI

InChI=1S/C23H32N4O2/c1-17(2)21(26-22(28)20-7-4-3-5-8-20)23(29)24-15-18-9-11-19(12-10-18)16-27-14-6-13-25-27/h6,9-14,17,20-21H,3-5,7-8,15-16H2,1-2H3,(H,24,29)(H,26,28)/t21-/m1/s1