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

Systemtic Name: 3,6-bis(chloranyl)-N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[(2-ethyl-6-methylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[(2-ethyl-6-methyl-phenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C19H16Cl2N2OS2 MolecularWeight: 423.37914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C19H16Cl2N2OS2/c1-3-11-6-4-5-10(2)16(11)22-19(25)23-18(24)17-15(21)13-8-7-12(20)9-14(13)26-17/h4-9H,3H2,1-2H3,(H2,22,23,24,25)