3-(4-bromophenyl)-N-[1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-bromophenyl)-N-[1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-bromophenyl)-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-bromophenyl)-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-bromophenyl)-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-bromophenyl)-N-[1-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]-1H-pyrazole-5-carboxamide Formula: C20H17BrN4O3 MolecularWeight: 441.27798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCC(=O)N2)NC(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCC(=O)N2)NC(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H17BrN4O3/c1-11(13-4-7-18-16(8-13)23-19(26)10-28-18)22-20(27)17-9-15(24-25-17)12-2-5-14(21)6-3-12/h2-9,11H,10H2,1H3,(H,22,27)(H,23,26)(H,24,25)