3,6-bis(chloranyl)-N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[(4-iodanyl-2-methyl-phenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[(4-iodo-2-methyl-phenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[(4-iodo-2-methylanilino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[(4-iodo-2-methylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[(4-iodo-2-methyl-phenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C17H11Cl2IN2OS2 MolecularWeight: 521.22251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H11Cl2IN2OS2/c1-8-6-10(20)3-5-12(8)21-17(24)22-16(23)15-14(19)11-4-2-9(18)7-13(11)25-15/h2-7H,1H3,(H2,21,22,23,24)