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

Systemtic Name: N-[(4-bromanyl-3-methyl-phenyl)carbamothioyl]-3,6-bis(chloranyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[(4-bromo-3-methyl-phenyl)carbamothioyl]-3,6-dichloro-benzothiophene-2-carboxamide CAS Name: N-[(4-bromo-3-methylanilino)-sulfanylidenemethyl]-3,6-dichloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(4-bromo-3-methylphenyl)carbamothioyl]-3,6-dichloro-1-benzothiophene-2-carboxamide Traditional Name: N-[(4-bromo-3-methyl-phenyl)thiocarbamoyl]-3,6-dichloro-benzothiophene-2-carboxamide Formula: C17H11BrCl2N2OS2 MolecularWeight: 474.22204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H11BrCl2N2OS2/c1-8-6-10(3-5-12(8)18)21-17(24)22-16(23)15-14(20)11-4-2-9(19)7-13(11)25-15/h2-7H,1H3,(H2,21,22,23,24)