N-[[4-bromanyl-2-(phenylcarbonyl)phenyl]carbamothioyl]-2,5-bis(chloranyl)thiophene-3-carboxamide

Systemtic Name: N-[[4-bromanyl-2-(phenylcarbonyl)phenyl]carbamothioyl]-2,5-bis(chloranyl)thiophene-3-carboxamide Openeye Name: N-[(2-benzoyl-4-bromo-phenyl)carbamothioyl]-2,5-dichloro-thiophene-3-carboxamide CAS Name: N-[(2-benzoyl-4-bromoanilino)-sulfanylidenemethyl]-2,5-dichloro-3-thiophenecarboxamide IUPAC Name: N-[(2-benzoyl-4-bromophenyl)carbamothioyl]-2,5-dichlorothiophene-3-carboxamide Traditional Name: N-[(2-benzoyl-4-bromo-phenyl)thiocarbamoyl]-2,5-dichloro-thiophene-3-carboxamide Formula: C19H11BrCl2N2O2S2 MolecularWeight: 514.24284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=S)NC(=O)C3=C(SC(=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=S)NC(=O)C3=C(SC(=C3)Cl)Cl

InChI

InChI=1S/C19H11BrCl2N2O2S2/c20-11-6-7-14(12(8-11)16(25)10-4-2-1-3-5-10)23-19(27)24-18(26)13-9-15(21)28-17(13)22/h1-9H,(H2,23,24,26,27)