1-[(4-tert-butylphenoxy)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-tert-butylphenoxy)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-tert-butylphenoxy)methyl]-N-[4-(1-piperidylmethyl)phenyl]pyrazole-3-carboxamide CAS Name: 1-[(4-tert-butylphenoxy)methyl]-N-[4-(1-piperidinylmethyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-tert-butylphenoxy)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-tert-butylphenoxy)methyl]-N-[4-(piperidinomethyl)phenyl]pyrazole-3-carboxamide Formula: C27H34N4O2 MolecularWeight: 446.58446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC=C(C=C3)CN4CCCCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC=C(C=C3)CN4CCCCC4

InChI

InChI=1S/C27H34N4O2/c1-27(2,3)22-9-13-24(14-10-22)33-20-31-18-15-25(29-31)26(32)28-23-11-7-21(8-12-23)19-30-16-5-4-6-17-30/h7-15,18H,4-6,16-17,19-20H2,1-3H3,(H,28,32)