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

Systemtic Name: 5-chloranyl-3-methyl-N-[1-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-N-[1-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-[1-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl]-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C21H19ClN4O3 MolecularWeight: 410.85356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC(C)C2=CC3=C(C=C2)OCC(=O)N3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC(C)C2=CC3=C(C=C2)OCC(=O)N3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H19ClN4O3/c1-12(14-8-9-17-16(10-14)24-18(27)11-29-17)23-21(28)19-13(2)25-26(20(19)22)15-6-4-3-5-7-15/h3-10,12H,11H2,1-2H3,(H,23,28)(H,24,27)