4-[1-azanyl-2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-N-(4-azanyl-1-phenyl-pyrazol-3-yl)benzamide

Systemtic Name: 4-[1-azanyl-2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-N-(4-azanyl-1-phenyl-pyrazol-3-yl)benzamide Openeye Name: 4-[1-amino-2-(isoxazol-3-ylamino)-2-oxo-ethyl]-N-(4-amino-1-phenyl-pyrazol-3-yl)benzamide CAS Name: 4-[1-amino-2-(3-isoxazolylamino)-2-oxoethyl]-N-(4-amino-1-phenyl-3-pyrazolyl)benzamide IUPAC Name: 4-[1-amino-2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-(4-amino-1-phenylpyrazol-3-yl)benzamide Traditional Name: 4-[1-amino-2-(isoxazol-3-ylamino)-2-keto-ethyl]-N-(4-amino-1-phenyl-pyrazol-3-yl)benzamide Formula: C21H19N7O3 MolecularWeight: 417.42066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)NC(=O)C3=CC=C(C=C3)C(C(=O)NC4=NOC=C4)N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)NC(=O)C3=CC=C(C=C3)C(C(=O)NC4=NOC=C4)N)N

InChI

InChI=1S/C21H19N7O3/c22-16-12-28(15-4-2-1-3-5-15)26-19(16)25-20(29)14-8-6-13(7-9-14)18(23)21(30)24-17-10-11-31-27-17/h1-12,18H,22-23H2,(H,24,27,30)(H,25,26,29)