4-bromanyl-N-[1-(1,3-diphenylpyrazol-4-yl)-3-morpholin-4-yl-3-oxidanylidene-prop-1-en-2-yl]benzamide

Systemtic Name: 4-bromanyl-N-[1-(1,3-diphenylpyrazol-4-yl)-3-morpholin-4-yl-3-oxidanylidene-prop-1-en-2-yl]benzamide Openeye Name: 4-bromo-N-[2-(1,3-diphenylpyrazol-4-yl)-1-(morpholine-4-carbonyl)vinyl]benzamide CAS Name: 4-bromo-N-[1-(1,3-diphenyl-4-pyrazolyl)-3-(4-morpholinyl)-3-oxoprop-1-en-2-yl]benzamide IUPAC Name: 4-bromo-N-[1-(1,3-diphenylpyrazol-4-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide Traditional Name: 4-bromo-N-[2-(1,3-diphenylpyrazol-4-yl)-1-(morpholine-4-carbonyl)vinyl]benzamide Formula: C29H25BrN4O3 MolecularWeight: 557.4378

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

C1COCCN1C(=O)C(=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C29H25BrN4O3/c30-24-13-11-22(12-14-24)28(35)31-26(29(36)33-15-17-37-18-16-33)19-23-20-34(25-9-5-2-6-10-25)32-27(23)21-7-3-1-4-8-21/h1-14,19-20H,15-18H2,(H,31,35)