S-(4-methylphenyl) 1-methyl-5-pyrrol-1-yl-pyrazole-4-carbothioate

Systemtic Name: S-(4-methylphenyl) 1-methyl-5-pyrrol-1-yl-pyrazole-4-carbothioate Openeye Name: S-(p-tolyl) 1-methyl-5-pyrrol-1-yl-pyrazole-4-carbothioate CAS Name: 1-methyl-5-(1-pyrrolyl)-4-pyrazolecarbothioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 1-methyl-5-pyrrol-1-ylpyrazole-4-carbothioate Traditional Name: 1-methyl-5-pyrrol-1-yl-pyrazole-4-carbothioic acid S-(p-tolyl) ester Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)C2=C(N(N=C2)C)N3C=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)C2=C(N(N=C2)C)N3C=CC=C3

InChI

InChI=1S/C16H15N3OS/c1-12-5-7-13(8-6-12)21-16(20)14-11-17-18(2)15(14)19-9-3-4-10-19/h3-11H,1-2H3