N-[(5-phenyl-1H-pyrazol-4-yl)methyl]-2-pyrimidin-2-ylsulfanyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamide

Systemtic Name: N-[(5-phenyl-1H-pyrazol-4-yl)methyl]-2-pyrimidin-2-ylsulfanyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamide Openeye Name: N-[(5-phenyl-1H-pyrazol-4-yl)methyl]-2-pyrimidin-2-ylsulfanyl-N-tetralin-1-yl-acetamide CAS Name: N-[(5-phenyl-1H-pyrazol-4-yl)methyl]-2-(2-pyrimidinylthio)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide IUPAC Name: N-[(5-phenyl-1H-pyrazol-4-yl)methyl]-2-pyrimidin-2-ylsulfanyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide Traditional Name: N-[(5-phenyl-1H-pyrazol-4-yl)methyl]-2-(2-pyrimidylthio)-N-tetralin-1-yl-acetamide Formula: C26H25N5OS MolecularWeight: 455.5746

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1)N(CC3=C(NN=C3)C4=CC=CC=C4)C(=O)CSC5=NC=CC=N5

Isomeric SMILES

C1CC(C2=CC=CC=C2C1)N(CC3=C(NN=C3)C4=CC=CC=C4)C(=O)CSC5=NC=CC=N5

InChI

InChI=1S/C26H25N5OS/c32-24(18-33-26-27-14-7-15-28-26)31(23-13-6-11-19-8-4-5-12-22(19)23)17-21-16-29-30-25(21)20-9-2-1-3-10-20/h1-5,7-10,12,14-16,23H,6,11,13,17-18H2,(H,29,30)