5-azanyl-1-[2-(2,4-ditert-butylphenoxy)ethanoyl]pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[2-(2,4-ditert-butylphenoxy)ethanoyl]pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[2-(2,4-ditert-butylphenoxy)acetyl]pyrazole-4-carbonitrile CAS Name: 5-amino-1-[2-(2,4-ditert-butylphenoxy)-1-oxoethyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[2-(2,4-ditert-butylphenoxy)acetyl]pyrazole-4-carbonitrile Traditional Name: 5-amino-1-[2-(2,4-ditert-butylphenoxy)acetyl]pyrazole-4-carbonitrile Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)N2C(=C(C=N2)C#N)N)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)N2C(=C(C=N2)C#N)N)C(C)(C)C

InChI

InChI=1S/C20H26N4O2/c1-19(2,3)14-7-8-16(15(9-14)20(4,5)6)26-12-17(25)24-18(22)13(10-21)11-23-24/h7-9,11H,12,22H2,1-6H3