3-chloranyl-6-methoxy-N-[[2-(4-phenylphenoxy)ethanoylamino]carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-methoxy-N-[[2-(4-phenylphenoxy)ethanoylamino]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-methoxy-N-[[[2-(4-phenylphenoxy)acetyl]amino]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-6-methoxy-N-[[[1-oxo-2-(4-phenylphenoxy)ethyl]hydrazo]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-methoxy-N-[[[2-(4-phenylphenoxy)acetyl]amino]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-methoxy-N-[[[2-(4-phenylphenoxy)acetyl]amino]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C25H20ClN3O4S2 MolecularWeight: 526.027

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)COC3=CC=C(C=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)COC3=CC=C(C=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H20ClN3O4S2/c1-32-18-11-12-19-20(13-18)35-23(22(19)26)24(31)27-25(34)29-28-21(30)14-33-17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-13H,14H2,1H3,(H,28,30)(H2,27,29,31,34)