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

Systemtic Name: 1-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-[1-(dipentylamino)propan-2-yl]pyrazole-3-carboxamide Openeye Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]-N-[2-(dipentylamino)-1-methyl-ethyl]pyrazole-3-carboxamide CAS Name: 1-[(4-chloro-3-methylphenoxy)methyl]-N-[1-(dipentylamino)propan-2-yl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-chloro-3-methylphenoxy)methyl]-N-[1-(dipentylamino)propan-2-yl]pyrazole-3-carboxamide Traditional Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]-N-[2-(diamylamino)-1-methyl-ethyl]pyrazole-3-carboxamide Formula: C25H39ClN4O2 MolecularWeight: 463.05576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H39ClN4O2/c1-5-7-9-14-29(15-10-8-6-2)18-21(4)27-25(31)24-13-16-30(28-24)19-32-22-11-12-23(26)20(3)17-22/h11-13,16-17,21H,5-10,14-15,18-19H2,1-4H3,(H,27,31)