4-[(3,4-dimethoxyphenyl)carbamothioylamino]-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-[(3,4-dimethoxyphenyl)carbamothioylamino]-2-ethyl-pyrazole-3-carboxamide Openeye Name: 4-[(3,4-dimethoxyphenyl)carbamothioylamino]-2-ethyl-pyrazole-3-carboxamide CAS Name: 4-[[(3,4-dimethoxyanilino)-sulfanylidenemethyl]amino]-2-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-[(3,4-dimethoxyphenyl)carbamothioylamino]-2-ethylpyrazole-3-carboxamide Traditional Name: 4-[(3,4-dimethoxyphenyl)thiocarbamoylamino]-2-ethyl-pyrazole-3-carboxamide Formula: C15H19N5O3S MolecularWeight: 349.40806

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NC(=S)NC2=CC(=C(C=C2)OC)OC)C(=O)N

Isomeric SMILES

CCN1C(=C(C=N1)NC(=S)NC2=CC(=C(C=C2)OC)OC)C(=O)N

InChI

InChI=1S/C15H19N5O3S/c1-4-20-13(14(16)21)10(8-17-20)19-15(24)18-9-5-6-11(22-2)12(7-9)23-3/h5-8H,4H2,1-3H3,(H2,16,21)(H2,18,19,24)