S-[2-[bis(3,5-dimethylpyrazol-1-yl)methyl]phenyl] N,N-dimethylcarbamothioate

Systemtic Name: S-[2-[bis(3,5-dimethylpyrazol-1-yl)methyl]phenyl] N,N-dimethylcarbamothioate Openeye Name: S-[2-[bis(3,5-dimethylpyrazol-1-yl)methyl]phenyl] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[2-[bis(3,5-dimethyl-1-pyrazolyl)methyl]phenyl] ester IUPAC Name: S-[2-[bis(3,5-dimethylpyrazol-1-yl)methyl]phenyl] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-[2-[bis(3,5-dimethylpyrazol-1-yl)methyl]phenyl] ester Formula: C20H25N5OS MolecularWeight: 383.5104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C2=CC=CC=C2SC(=O)N(C)C)N3C(=CC(=N3)C)C)C

Isomeric SMILES

CC1=CC(=NN1C(C2=CC=CC=C2SC(=O)N(C)C)N3C(=CC(=N3)C)C)C

InChI

InChI=1S/C20H25N5OS/c1-13-11-15(3)24(21-13)19(25-16(4)12-14(2)22-25)17-9-7-8-10-18(17)27-20(26)23(5)6/h7-12,19H,1-6H3