N-[(4-fluorophenyl)carbamothioyl]-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide

Systemtic Name: N-[(4-fluorophenyl)carbamothioyl]-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide Openeye Name: N-[(4-fluorophenyl)carbamothioyl]-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide CAS Name: N-[(4-fluoroanilino)-sulfanylidenemethyl]-4-methyl-6-phenyl-2-thieno[2,3-b]pyrrolecarboxamide IUPAC Name: N-[(4-fluorophenyl)carbamothioyl]-4-methyl-6-phenylthieno[2,3-b]pyrrole-2-carboxamide Traditional Name: N-[(4-fluorophenyl)thiocarbamoyl]-4-methyl-6-phenyl-thieno[2,3-b]pyrrole-2-carboxamide Formula: C21H16FN3OS2 MolecularWeight: 409.499643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=C1C=C(S2)C(=O)NC(=S)NC3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC1=CN(C2=C1C=C(S2)C(=O)NC(=S)NC3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C21H16FN3OS2/c1-13-12-25(16-5-3-2-4-6-16)20-17(13)11-18(28-20)19(26)24-21(27)23-15-9-7-14(22)8-10-15/h2-12H,1H3,(H2,23,24,26,27)