N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-4-methyl-piperidine-1-carbothioamide

Systemtic Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-4-methyl-piperidine-1-carbothioamide Openeye Name: N-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]-4-methyl-piperidine-1-carbothioamide CAS Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]-4-methyl-1-piperidinecarbothioamide IUPAC Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-4-methylpiperidine-1-carbothioamide Traditional Name: N-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]-4-methyl-piperidine-1-carbothioamide Formula: C20H28N4S MolecularWeight: 356.52812

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)NC2=C(N(N=C2C)CC3=CC=CC=C3C)C

Isomeric SMILES

CC1CCN(CC1)C(=S)NC2=C(N(N=C2C)CC3=CC=CC=C3C)C

InChI

InChI=1S/C20H28N4S/c1-14-9-11-23(12-10-14)20(25)21-19-16(3)22-24(17(19)4)13-18-8-6-5-7-15(18)2/h5-8,14H,9-13H2,1-4H3,(H,21,25)