4-bromanyl-N-[3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-bromo-N-[3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-3-oxo-propyl]benzamide CAS Name: 4-bromo-N-[3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-3-oxopropyl]benzamide IUPAC Name: 4-bromo-N-[3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-3-oxopropyl]benzamide Traditional Name: 4-bromo-N-[3-keto-3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]propyl]benzamide Formula: C21H21BrN4O3 MolecularWeight: 457.32044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H21BrN4O3/c1-14-19(21(29)26(25(14)2)17-6-4-3-5-7-17)24-18(27)12-13-23-20(28)15-8-10-16(22)11-9-15/h3-11H,12-13H2,1-2H3,(H,23,28)(H,24,27)