5-(3,4-dimethylphenyl)-N-[(3,5-dimethylphenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(3,4-dimethylphenyl)-N-[(3,5-dimethylphenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3,4-dimethylphenyl)-N-[(3,5-dimethylphenyl)carbamothioyl]furan-2-carboxamide CAS Name: N-[(3,5-dimethylanilino)-sulfanylidenemethyl]-5-(3,4-dimethylphenyl)-2-furancarboxamide IUPAC Name: 5-(3,4-dimethylphenyl)-N-[(3,5-dimethylphenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3,4-dimethylphenyl)-N-[(3,5-dimethylphenyl)thiocarbamoyl]-2-furamide Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=CC(=CC(=C3)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=CC(=CC(=C3)C)C)C

InChI

InChI=1S/C22H22N2O2S/c1-13-9-14(2)11-18(10-13)23-22(27)24-21(25)20-8-7-19(26-20)17-6-5-15(3)16(4)12-17/h5-12H,1-4H3,(H2,23,24,25,27)