N'-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanylethanoyl]-4-methyl-benzohydrazide

Systemtic Name: N'-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanylethanoyl]-4-methyl-benzohydrazide Openeye Name: N'-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfanylacetyl]-4-methyl-benzohydrazide CAS Name: N'-[2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)thio]-1-oxoethyl]-4-methylbenzohydrazide IUPAC Name: N'-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfanylacetyl]-4-methylbenzohydrazide Traditional Name: N'-[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)thio]acetyl]-4-methyl-benzohydrazide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC(=O)CSC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC(=O)CSC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H22N4O2S/c1-14-9-11-17(12-10-14)21(27)23-22-19(26)13-28-20-15(2)24-25(16(20)3)18-7-5-4-6-8-18/h4-12H,13H2,1-3H3,(H,22,26)(H,23,27)