3-(5-methylfuran-2-yl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(5-methylfuran-2-yl)-N-[3-(2-oxidanylideneazepan-1-yl)propyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(5-methyl-2-furyl)-N-[3-(2-oxoazepan-1-yl)propyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(5-methyl-2-furanyl)-N-[3-(2-oxo-1-azepanyl)propyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(5-methylfuran-2-yl)-N-[3-(2-oxoazepan-1-yl)propyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-3-(5-methyl-2-furyl)-1-phenyl-pyrazole-4-carboxamide Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NN(C=C2C(=O)NCCCN3CCCCCC3=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(O1)C2=NN(C=C2C(=O)NCCCN3CCCCCC3=O)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O3/c1-18-12-13-21(31-18)23-20(17-28(26-23)19-9-4-2-5-10-19)24(30)25-14-8-16-27-15-7-3-6-11-22(27)29/h2,4-5,9-10,12-13,17H,3,6-8,11,14-16H2,1H3,(H,25,30)