(2-butyl-1,3-benzoxazol-5-yl)-[(2S)-2-(2-pyrazol-1-ylethyl)piperidin-1-yl]methanone

Systemtic Name: (2-butyl-1,3-benzoxazol-5-yl)-[(2S)-2-(2-pyrazol-1-ylethyl)piperidin-1-yl]methanone Openeye Name: (2-butyl-1,3-benzoxazol-5-yl)-[(2S)-2-(2-pyrazol-1-ylethyl)-1-piperidyl]methanone CAS Name: (2-butyl-1,3-benzoxazol-5-yl)-[(2S)-2-[2-(1-pyrazolyl)ethyl]-1-piperidinyl]methanone IUPAC Name: (2-butyl-1,3-benzoxazol-5-yl)-[(2S)-2-(2-pyrazol-1-ylethyl)piperidin-1-yl]methanone Traditional Name: (2-butyl-1,3-benzoxazol-5-yl)-[(2S)-2-(2-pyrazol-1-ylethyl)piperidino]methanone Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(O1)C=CC(=C2)C(=O)N3CCCCC3CCN4C=CC=N4

Isomeric SMILES

CCCCC1=NC2=C(O1)C=CC(=C2)C(=O)N3CCCC[C@H]3CCN4C=CC=N4

InChI

InChI=1S/C22H28N4O2/c1-2-3-8-21-24-19-16-17(9-10-20(19)28-21)22(27)26-14-5-4-7-18(26)11-15-25-13-6-12-23-25/h6,9-10,12-13,16,18H,2-5,7-8,11,14-15H2,1H3/t18-/m0/s1