4-bromanyl-N-[3-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]amino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]amino]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-bromo-N-[3-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]amino]-3-oxo-propyl]benzamide CAS Name: 4-bromo-N-[3-[[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]amino]-3-oxopropyl]benzamide IUPAC Name: 4-bromo-N-[3-[[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]amino]-3-oxopropyl]benzamide Traditional Name: 4-bromo-N-[3-[[2-(4-ethylbenzyl)pyrazol-3-yl]amino]-3-keto-propyl]benzamide Formula: C22H23BrN4O2 MolecularWeight: 455.34762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)CCNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H23BrN4O2/c1-2-16-3-5-17(6-4-16)15-27-20(11-14-25-27)26-21(28)12-13-24-22(29)18-7-9-19(23)10-8-18/h3-11,14H,2,12-13,15H2,1H3,(H,24,29)(H,26,28)