3-bromanyl-N-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamothioyl]-4-methoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)thiocarbamoyl]-4-methoxy-benzamide Formula: C17H14BrN3O2S2 MolecularWeight: 436.34596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C3=C(S2)CCC3)C#N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C3=C(S2)CCC3)C#N)Br

InChI

InChI=1S/C17H14BrN3O2S2/c1-23-13-6-5-9(7-12(13)18)15(22)20-17(24)21-16-11(8-19)10-3-2-4-14(10)25-16/h5-7H,2-4H2,1H3,(H2,20,21,22,24)