3-methyl-N-(phenethylcarbamothioyl)-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: 3-methyl-N-(phenethylcarbamothioyl)-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: 3-methyl-N-(phenethylcarbamothioyl)-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: 3-methyl-N-[(phenethylamino)-sulfanylidenemethyl]-1-phenyl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: 3-methyl-N-(phenethylcarbamothioyl)-1-phenylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: 3-methyl-N-(phenethylthiocarbamoyl)-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C22H20N4OS2 MolecularWeight: 420.5504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC(=S)NCCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NC(=S)NCCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4OS2/c1-15-18-14-19(29-21(18)26(25-15)17-10-6-3-7-11-17)20(27)24-22(28)23-13-12-16-8-4-2-5-9-16/h2-11,14H,12-13H2,1H3,(H2,23,24,27,28)