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

Systemtic Name: N-[4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-(1H-pyrazol-5-yl)phenyl]butanamide Openeye Name: N-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-(1H-pyrazol-5-yl)phenyl]butanamide CAS Name: N-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-(1H-pyrazol-5-yl)phenyl]butanamide IUPAC Name: N-[4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-(1H-pyrazol-5-yl)phenyl]butanamide Traditional Name: N-[4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-(1H-pyrazol-5-yl)phenyl]butyramide Formula: C20H30N4O3 MolecularWeight: 374.4772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N4O3/c1-5-6-19(26)23-14-7-8-18(16(11-14)17-9-10-22-24-17)27-13-15(25)12-21-20(2,3)4/h7-11,15,21,25H,5-6,12-13H2,1-4H3,(H,22,24)(H,23,26)