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

Systemtic Name: 5-(3,4-dimethylphenyl)-N-[(3-ethanoylphenyl)carbamothioyl]furan-2-carboxamide Openeye Name: N-[(3-acetylphenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide CAS Name: N-[(3-acetylanilino)-sulfanylidenemethyl]-5-(3,4-dimethylphenyl)-2-furancarboxamide IUPAC Name: N-[(3-acetylphenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide Traditional Name: N-[(3-acetylphenyl)thiocarbamoyl]-5-(3,4-dimethylphenyl)-2-furamide Formula: C22H20N2O3S MolecularWeight: 392.4708

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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(=O)C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2O3S/c1-13-7-8-17(11-14(13)2)19-9-10-20(27-19)21(26)24-22(28)23-18-6-4-5-16(12-18)15(3)25/h4-12H,1-3H3,(H2,23,24,26,28)