N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: N-[2-(4-bromobenzyl)pyrazol-3-yl]-3-(3-keto-1,4-benzoxazin-4-yl)propionamide Formula: C21H19BrN4O3 MolecularWeight: 455.30456

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H19BrN4O3/c22-16-7-5-15(6-8-16)13-26-19(9-11-23-26)24-20(27)10-12-25-17-3-1-2-4-18(17)29-14-21(25)28/h1-9,11H,10,12-14H2,(H,24,27)