N-butyl-N-[2-[[2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-butyl-N-[2-[[2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-butyl-N-[2-oxo-2-[[5-phenyl-2-(p-tolyl)pyrazol-3-yl]amino]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-butyl-N-[2-[[2-(4-methylphenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-butyl-N-[2-[[2-(4-methylphenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-butyl-N-[2-keto-2-[[5-phenyl-2-(p-tolyl)pyrazol-3-yl]amino]ethyl]-piperonylamide Formula: C30H30N4O4 MolecularWeight: 510.5836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)C)C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)C)C3=CC=CC=C3)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C30H30N4O4/c1-3-4-16-33(30(36)23-12-15-26-27(17-23)38-20-37-26)19-29(35)31-28-18-25(22-8-6-5-7-9-22)32-34(28)24-13-10-21(2)11-14-24/h5-15,17-18H,3-4,16,19-20H2,1-2H3,(H,31,35)