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

Systemtic Name: N-[[2-(4-bromanylphenoxy)ethanoylamino]carbamothioyl]-3-chloranyl-6-methoxy-1-benzothiophene-2-carboxamide Openeye Name: N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-3-chloro-6-methoxy-benzothiophene-2-carboxamide CAS Name: N-[[[2-(4-bromophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-chloro-6-methoxy-1-benzothiophene-2-carboxamide IUPAC Name: N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-3-chloro-6-methoxy-1-benzothiophene-2-carboxamide Traditional Name: N-[[[2-(4-bromophenoxy)acetyl]amino]thiocarbamoyl]-3-chloro-6-methoxy-benzothiophene-2-carboxamide Formula: C19H15BrClN3O4S2 MolecularWeight: 528.8271

Click to see the large picture

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)Br)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H15BrClN3O4S2/c1-27-12-6-7-13-14(8-12)30-17(16(13)21)18(26)22-19(29)24-23-15(25)9-28-11-4-2-10(20)3-5-11/h2-8H,9H2,1H3,(H,23,25)(H2,22,24,26,29)