N-[(5-tert-butyl-2-oxidanyl-phenyl)carbamothioyl]-3,6-bis(chloranyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(5-tert-butyl-2-oxidanyl-phenyl)carbamothioyl]-3,6-bis(chloranyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[(5-tert-butyl-2-hydroxy-phenyl)carbamothioyl]-3,6-dichloro-benzothiophene-2-carboxamide CAS Name: N-[(5-tert-butyl-2-hydroxyanilino)-sulfanylidenemethyl]-3,6-dichloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]-3,6-dichloro-1-benzothiophene-2-carboxamide Traditional Name: N-[(5-tert-butyl-2-hydroxy-phenyl)thiocarbamoyl]-3,6-dichloro-benzothiophene-2-carboxamide Formula: C20H18Cl2N2O2S2 MolecularWeight: 453.40512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18Cl2N2O2S2/c1-20(2,3)10-4-7-14(25)13(8-10)23-19(27)24-18(26)17-16(22)12-6-5-11(21)9-15(12)28-17/h4-9,25H,1-3H3,(H2,23,24,26,27)