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

Systemtic Name: 2-[(4-methoxyphenyl)carbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)ethanamide Openeye Name: 2-[(4-methoxyphenyl)carbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide CAS Name: 2-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]-N-(1,3,5-trimethyl-4-pyrazolyl)acetamide IUPAC Name: 2-[(4-methoxyphenyl)carbamothioylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Traditional Name: 2-[(4-methoxyphenyl)thiocarbamoylamino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CNC(=S)NC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CNC(=S)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H21N5O2S/c1-10-15(11(2)21(3)20-10)19-14(22)9-17-16(24)18-12-5-7-13(23-4)8-6-12/h5-8H,9H2,1-4H3,(H,19,22)(H2,17,18,24)