N-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)carbamothioyl]-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide

Systemtic Name: N-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)carbamothioyl]-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide Openeye Name: N-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)carbamothioyl]-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide CAS Name: N-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-sulfanylidenemethyl]-4-methyl-6-phenyl-2-thieno[2,3-b]pyrrolecarboxamide IUPAC Name: N-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamothioyl]-4-methyl-6-phenylthieno[2,3-b]pyrrole-2-carboxamide Traditional Name: N-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)thiocarbamoyl]-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide Formula: C26H23N5O2S2 MolecularWeight: 501.62312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=C1C=C(S2)C(=O)NC(=S)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CN(C2=C1C=C(S2)C(=O)NC(=S)NC3=C(N(N(C3=O)C4=CC=CC=C4)C)C)C5=CC=CC=C5

InChI

InChI=1S/C26H23N5O2S2/c1-16-15-30(18-10-6-4-7-11-18)25-20(16)14-21(35-25)23(32)28-26(34)27-22-17(2)29(3)31(24(22)33)19-12-8-5-9-13-19/h4-15H,1-3H3,(H2,27,28,32,34)