3-chloranyl-N-[[(5-methyl-1H-pyrazol-3-yl)carbonylamino]carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[[(5-methyl-1H-pyrazol-3-yl)carbonylamino]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[(5-methyl-1H-pyrazole-3-carbonyl)amino]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[[(5-methyl-1H-pyrazol-3-yl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[(5-methyl-1H-pyrazole-3-carbonyl)amino]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[[(5-methyl-1H-pyrazole-3-carbonyl)amino]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C15H12ClN5O2S2 MolecularWeight: 393.87108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)NNC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC1=CC(=NN1)C(=O)NNC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C15H12ClN5O2S2/c1-7-6-9(19-18-7)13(22)20-21-15(24)17-14(23)12-11(16)8-4-2-3-5-10(8)25-12/h2-6H,1H3,(H,18,19)(H,20,22)(H2,17,21,23,24)