4-[[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl-(furan-2-ylmethyl)amino]methyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl-(furan-2-ylmethyl)amino]methyl]-N-cyclopropyl-benzamide Openeye Name: 4-[[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl-(2-furylmethyl)amino]methyl]-N-cyclopropyl-benzamide CAS Name: 4-[[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl-(2-furanylmethyl)amino]methyl]-N-cyclopropylbenzamide IUPAC Name: 4-[[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl-(furan-2-ylmethyl)amino]methyl]-N-cyclopropylbenzamide Traditional Name: 4-[[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl-(2-furfuryl)amino]methyl]-N-cyclopropyl-benzamide Formula: C27H27ClN4O2 MolecularWeight: 474.98188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN(CC2=CC=C(C=C2)C(=O)NC3CC3)CC4=CC=CO4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1CN(CC2=CC=C(C=C2)C(=O)NC3CC3)CC4=CC=CO4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C27H27ClN4O2/c1-19-25(26(28)32(30-19)23-6-3-2-4-7-23)18-31(17-24-8-5-15-34-24)16-20-9-11-21(12-10-20)27(33)29-22-13-14-22/h2-12,15,22H,13-14,16-18H2,1H3,(H,29,33)