3-chloranyl-N-[3-[1-oxidanylidene-1-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)amino]butan-2-yl]sulfanylphenyl]benzamide

Systemtic Name: 3-chloranyl-N-[3-[1-oxidanylidene-1-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)amino]butan-2-yl]sulfanylphenyl]benzamide Openeye Name: 3-chloro-N-[3-[1-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)carbamoyl]propylsulfanyl]phenyl]benzamide CAS Name: 3-chloro-N-[3-[[1-oxo-1-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]butan-2-yl]thio]phenyl]benzamide IUPAC Name: 3-chloro-N-[3-[1-oxo-1-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]butan-2-yl]sulfanylphenyl]benzamide Traditional Name: 3-chloro-N-[3-[1-[(5-keto-1-phenyl-2-pyrazolin-3-yl)carbamoyl]propylthio]phenyl]benzamide Formula: C26H23ClN4O3S MolecularWeight: 507.00382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN(C(=O)C1)C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCC(C(=O)NC1=NN(C(=O)C1)C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H23ClN4O3S/c1-2-22(26(34)29-23-16-24(32)31(30-23)20-11-4-3-5-12-20)35-21-13-7-10-19(15-21)28-25(33)17-8-6-9-18(27)14-17/h3-15,22H,2,16H2,1H3,(H,28,33)(H,29,30,34)