3-chloranyl-N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(4-indolin-1-ylsulfonylphenyl)carbamothioyl]-6-methoxy-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[4-(2,3-dihydroindol-1-ylsulfonyl)anilino]-sulfanylidenemethyl]-6-methoxy-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(4-indolin-1-ylsulfonylphenyl)thiocarbamoyl]-6-methoxy-benzothiophene-2-carboxamide Formula: C25H20ClN3O4S3 MolecularWeight: 558.092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C54)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C54)Cl

InChI

InChI=1S/C25H20ClN3O4S3/c1-33-17-8-11-19-21(14-17)35-23(22(19)26)24(30)28-25(34)27-16-6-9-18(10-7-16)36(31,32)29-13-12-15-4-2-3-5-20(15)29/h2-11,14H,12-13H2,1H3,(H2,27,28,30,34)