2,4-bis(chloranyl)-N-[1-oxidanylidene-3-phenyl-1-(3-pyrazol-1-ylpropylamino)propan-2-yl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[1-oxidanylidene-3-phenyl-1-(3-pyrazol-1-ylpropylamino)propan-2-yl]benzamide Openeye Name: N-[1-benzyl-2-oxo-2-(3-pyrazol-1-ylpropylamino)ethyl]-2,4-dichloro-benzamide CAS Name: 2,4-dichloro-N-[1-oxo-3-phenyl-1-[3-(1-pyrazolyl)propylamino]propan-2-yl]benzamide IUPAC Name: 2,4-dichloro-N-[1-oxo-3-phenyl-1-(3-pyrazol-1-ylpropylamino)propan-2-yl]benzamide Traditional Name: N-[1-benzyl-2-keto-2-(3-pyrazol-1-ylpropylamino)ethyl]-2,4-dichloro-benzamide Formula: C22H22Cl2N4O2 MolecularWeight: 445.34168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCCCN2C=CC=N2)NC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NCCCN2C=CC=N2)NC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H22Cl2N4O2/c23-17-8-9-18(19(24)15-17)21(29)27-20(14-16-6-2-1-3-7-16)22(30)25-10-4-12-28-13-5-11-26-28/h1-3,5-9,11,13,15,20H,4,10,12,14H2,(H,25,30)(H,27,29)