2,5-dimethyl-N-[(4-pentoxyphenyl)carbamothioyl]pyrazole-3-carboxamide

Systemtic Name: 2,5-dimethyl-N-[(4-pentoxyphenyl)carbamothioyl]pyrazole-3-carboxamide Openeye Name: 2,5-dimethyl-N-[(4-pentoxyphenyl)carbamothioyl]pyrazole-3-carboxamide CAS Name: 2,5-dimethyl-N-[(4-pentoxyanilino)-sulfanylidenemethyl]-3-pyrazolecarboxamide IUPAC Name: 2,5-dimethyl-N-[(4-pentoxyphenyl)carbamothioyl]pyrazole-3-carboxamide Traditional Name: N-[(4-amoxyphenyl)thiocarbamoyl]-2,5-dimethyl-pyrazole-3-carboxamide Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=NN2C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=NN2C)C

InChI

InChI=1S/C18H24N4O2S/c1-4-5-6-11-24-15-9-7-14(8-10-15)19-18(25)20-17(23)16-12-13(2)21-22(16)3/h7-10,12H,4-6,11H2,1-3H3,(H2,19,20,23,25)