N-(4-methoxyphenyl)-4-methyl-pyrazole-1-carbothioamide

Systemtic Name: N-(4-methoxyphenyl)-4-methyl-pyrazole-1-carbothioamide Openeye Name: N-(4-methoxyphenyl)-4-methyl-pyrazole-1-carbothioamide CAS Name: N-(4-methoxyphenyl)-4-methyl-1-pyrazolecarbothioamide IUPAC Name: N-(4-methoxyphenyl)-4-methylpyrazole-1-carbothioamide Traditional Name: N-(4-methoxyphenyl)-4-methyl-pyrazole-1-carbothioamide Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1)C(=S)NC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CN(N=C1)C(=S)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C12H13N3OS/c1-9-7-13-15(8-9)12(17)14-10-3-5-11(16-2)6-4-10/h3-8H,1-2H3,(H,14,17)