N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-5-propan-2-yl-1-pyridin-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-5-propan-2-yl-1-pyridin-2-yl-pyrazole-4-carboxamide Openeye Name: 5-isopropyl-N-[2-(p-tolylmethylsulfanyl)ethyl]-1-(2-pyridyl)pyrazole-4-carboxamide CAS Name: N-[2-[(4-methylphenyl)methylthio]ethyl]-5-propan-2-yl-1-(2-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-5-propan-2-yl-1-pyridin-2-ylpyrazole-4-carboxamide Traditional Name: 5-isopropyl-N-[2-[(4-methylbenzyl)thio]ethyl]-1-(2-pyridyl)pyrazole-4-carboxamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)C2=C(N(N=C2)C3=CC=CC=N3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)C2=C(N(N=C2)C3=CC=CC=N3)C(C)C

InChI

InChI=1S/C22H26N4OS/c1-16(2)21-19(14-25-26(21)20-6-4-5-11-23-20)22(27)24-12-13-28-15-18-9-7-17(3)8-10-18/h4-11,14,16H,12-13,15H2,1-3H3,(H,24,27)