3-chloranyl-N-[(2,4,6-trimethylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(2,4,6-trimethylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(2,4,6-trimethylphenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[sulfanylidene-(2,4,6-trimethylanilino)methyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(2,4,6-trimethylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(mesitylthiocarbamoyl)benzothiophene-2-carboxamide Formula: C19H17ClN2OS2 MolecularWeight: 388.93408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C

InChI

InChI=1S/C19H17ClN2OS2/c1-10-8-11(2)16(12(3)9-10)21-19(24)22-18(23)17-15(20)13-6-4-5-7-14(13)25-17/h4-9H,1-3H3,(H2,21,22,23,24)