4-bromanyl-1-ethyl-N-[(2-methoxyphenyl)carbamothioyl]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1-ethyl-N-[(2-methoxyphenyl)carbamothioyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-1-ethyl-N-[(2-methoxyphenyl)carbamothioyl]pyrazole-3-carboxamide CAS Name: 4-bromo-1-ethyl-N-[(2-methoxyanilino)-sulfanylidenemethyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-1-ethyl-N-[(2-methoxyphenyl)carbamothioyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-1-ethyl-N-[(2-methoxyphenyl)thiocarbamoyl]pyrazole-3-carboxamide Formula: C14H15BrN4O2S MolecularWeight: 383.2635

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC(=S)NC2=CC=CC=C2OC)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC(=S)NC2=CC=CC=C2OC)Br

InChI

InChI=1S/C14H15BrN4O2S/c1-3-19-8-9(15)12(18-19)13(20)17-14(22)16-10-6-4-5-7-11(10)21-2/h4-8H,3H2,1-2H3,(H2,16,17,20,22)