N-[(E)-(3-bromanyl-4-methoxy-phenyl)methylideneamino]-5-tert-butyl-1H-pyrazole-3-carboxamide

Systemtic Name: N-[(E)-(3-bromanyl-4-methoxy-phenyl)methylideneamino]-5-tert-butyl-1H-pyrazole-3-carboxamide Openeye Name: N-[(E)-(3-bromo-4-methoxy-phenyl)methyleneamino]-5-tert-butyl-1H-pyrazole-3-carboxamide CAS Name: N-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-5-tert-butyl-1H-pyrazole-3-carboxamide IUPAC Name: N-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-5-tert-butyl-1H-pyrazole-3-carboxamide Traditional Name: N-[(E)-(3-bromo-4-methoxy-benzylidene)amino]-5-tert-butyl-1H-pyrazole-3-carboxamide Formula: C16H19BrN4O2 MolecularWeight: 379.25166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C(=O)NN=CC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C(=O)N/N=C/C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C16H19BrN4O2/c1-16(2,3)14-8-12(19-20-14)15(22)21-18-9-10-5-6-13(23-4)11(17)7-10/h5-9H,1-4H3,(H,19,20)(H,21,22)/b18-9+