1-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-N-[1-(dipentylamino)propan-2-yl]pyrazole-3-carboxamide

Systemtic Name: 1-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-N-[1-(dipentylamino)propan-2-yl]pyrazole-3-carboxamide Openeye Name: 1-[(2-bromo-4-chloro-phenoxy)methyl]-N-[2-(dipentylamino)-1-methyl-ethyl]pyrazole-3-carboxamide CAS Name: 1-[(2-bromo-4-chlorophenoxy)methyl]-N-[1-(dipentylamino)propan-2-yl]-3-pyrazolecarboxamide IUPAC Name: 1-[(2-bromo-4-chlorophenoxy)methyl]-N-[1-(dipentylamino)propan-2-yl]pyrazole-3-carboxamide Traditional Name: 1-[(2-bromo-4-chloro-phenoxy)methyl]-N-[2-(diamylamino)-1-methyl-ethyl]pyrazole-3-carboxamide Formula: C24H36BrClN4O2 MolecularWeight: 527.92524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)CC(C)NC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)Cl)Br

Isomeric SMILES

CCCCCN(CCCCC)CC(C)NC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)Cl)Br

InChI

InChI=1S/C24H36BrClN4O2/c1-4-6-8-13-29(14-9-7-5-2)17-19(3)27-24(31)22-12-15-30(28-22)18-32-23-11-10-20(26)16-21(23)25/h10-12,15-16,19H,4-9,13-14,17-18H2,1-3H3,(H,27,31)