4-bromanyl-N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamothioyl]-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-sulfanylidenemethyl]-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2,5-dimethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)thiocarbamoyl]-2,5-dimethyl-pyrazole-3-carboxamide Formula: C17H18BrN5OS2 MolecularWeight: 452.39172

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)C3=C(C(=NN3C)C)Br

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)C3=C(C(=NN3C)C)Br

InChI

InChI=1S/C17H18BrN5OS2/c1-8-4-5-10-11(7-19)16(26-12(10)6-8)21-17(25)20-15(24)14-13(18)9(2)22-23(14)3/h8H,4-6H2,1-3H3,(H2,20,21,24,25)