N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-2-phenyl-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-2-phenyl-2-phenylsulfanyl-ethanamide Openeye Name: N-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]-2-phenyl-2-phenylsulfanyl-acetamide CAS Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]-2-phenyl-2-(phenylthio)acetamide IUPAC Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-2-phenyl-2-phenylsulfanylacetamide Traditional Name: N-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]-2-phenyl-2-(phenylthio)acetamide Formula: C27H27N3OS MolecularWeight: 441.58778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4)C

InChI

InChI=1S/C27H27N3OS/c1-19-12-10-11-15-23(19)18-30-21(3)25(20(2)29-30)28-27(31)26(22-13-6-4-7-14-22)32-24-16-8-5-9-17-24/h4-17,26H,18H2,1-3H3,(H,28,31)