N-[[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]carbamothioyl]hexanamide Openeye Name: N-[[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]carbamothioyl]hexanamide CAS Name: N-[sulfanylidene-[4-[(1,3,5-trimethyl-4-pyrazolyl)methyl]anilino]methyl]hexanamide IUPAC Name: N-[[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]carbamothioyl]hexanamide Traditional Name: N-[[4-[(1,3,5-trimethylpyrazol-4-yl)methyl]phenyl]thiocarbamoyl]hexanamide Formula: C20H28N4OS MolecularWeight: 372.52752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)CC2=C(N(N=C2C)C)C

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)CC2=C(N(N=C2C)C)C

InChI

InChI=1S/C20H28N4OS/c1-5-6-7-8-19(25)22-20(26)21-17-11-9-16(10-12-17)13-18-14(2)23-24(4)15(18)3/h9-12H,5-8,13H2,1-4H3,(H2,21,22,25,26)