N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[2-(4-chloranylphenoxy)ethanoyl-(phenylmethyl)amino]ethanamide

Systemtic Name: N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)-2-[2-(4-chloranylphenoxy)ethanoyl-(phenylmethyl)amino]ethanamide Openeye Name: 2-[benzyl-[2-(4-chlorophenoxy)acetyl]amino]-N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: N-(5-tert-butyl-2-phenyl-3-pyrazolyl)-2-[[2-(4-chlorophenoxy)-1-oxoethyl]-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl-[2-(4-chlorophenoxy)acetyl]amino]-N-(5-tert-butyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-[benzyl-[2-(4-chlorophenoxy)acetyl]amino]-N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)acetamide Formula: C30H31ClN4O3 MolecularWeight: 531.04514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(CC2=CC=CC=C2)C(=O)COC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(CC2=CC=CC=C2)C(=O)COC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C30H31ClN4O3/c1-30(2,3)26-18-27(35(33-26)24-12-8-5-9-13-24)32-28(36)20-34(19-22-10-6-4-7-11-22)29(37)21-38-25-16-14-23(31)15-17-25/h4-18H,19-21H2,1-3H3,(H,32,36)