N-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-(1H-pyrazol-5-yl)phenyl]ethanamide

Systemtic Name: N-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-(1H-pyrazol-5-yl)phenyl]ethanamide Openeye Name: N-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-(1H-pyrazol-5-yl)phenyl]acetamide CAS Name: N-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-(1H-pyrazol-5-yl)phenyl]acetamide IUPAC Name: N-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-(1H-pyrazol-5-yl)phenyl]acetamide Traditional Name: N-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-(1H-pyrazol-5-yl)phenyl]acetamide Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O)C2=CC=NN2

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O)C2=CC=NN2

InChI

InChI=1S/C18H26N4O3/c1-12(23)21-13-5-6-17(15(9-13)16-7-8-20-22-16)25-11-14(24)10-19-18(2,3)4/h5-9,14,19,24H,10-11H2,1-4H3,(H,20,22)(H,21,23)