3-bromanyl-N-[2-oxidanylidene-2-[[4-(pyrazol-1-ylmethyl)phenyl]methylamino]ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-oxidanylidene-2-[[4-(pyrazol-1-ylmethyl)phenyl]methylamino]ethyl]benzamide Openeye Name: 3-bromo-N-[2-oxo-2-[[4-(pyrazol-1-ylmethyl)phenyl]methylamino]ethyl]benzamide CAS Name: 3-bromo-N-[2-oxo-2-[[4-(1-pyrazolylmethyl)phenyl]methylamino]ethyl]benzamide IUPAC Name: 3-bromo-N-[2-oxo-2-[[4-(pyrazol-1-ylmethyl)phenyl]methylamino]ethyl]benzamide Traditional Name: 3-bromo-N-[2-keto-2-[[4-(pyrazol-1-ylmethyl)benzyl]amino]ethyl]benzamide Formula: C20H19BrN4O2 MolecularWeight: 427.29446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)NCC(=O)NCC2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)NCC(=O)NCC2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C20H19BrN4O2/c21-18-4-1-3-17(11-18)20(27)23-13-19(26)22-12-15-5-7-16(8-6-15)14-25-10-2-9-24-25/h1-11H,12-14H2,(H,22,26)(H,23,27)