2-[(3-methylphenyl)carbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide

Systemtic Name: 2-[(3-methylphenyl)carbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-(m-tolylcarbamothioylamino)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[[(3-methylanilino)-sulfanylidenemethyl]amino]-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-[(3-methylphenyl)carbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-(m-tolylthiocarbamoylamino)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NCC(=O)NC2=C(N(N=C2C)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NCC(=O)NC2=C(N(N=C2C)C)C

InChI

InChI=1S/C16H21N5OS/c1-10-6-5-7-13(8-10)18-16(23)17-9-14(22)19-15-11(2)20-21(4)12(15)3/h5-8H,9H2,1-4H3,(H,19,22)(H2,17,18,23)