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

Systemtic Name: 5-(3,4-dimethylphenyl)-N-[[4-[(3-methylphenyl)carbonylamino]phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3,4-dimethylphenyl)-N-[[4-[(3-methylbenzoyl)amino]phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-(3,4-dimethylphenyl)-N-[[4-[[(3-methylphenyl)-oxomethyl]amino]anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3,4-dimethylphenyl)-N-[[4-[(3-methylbenzoyl)amino]phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3,4-dimethylphenyl)-N-[[4-(m-toluoylamino)phenyl]thiocarbamoyl]-2-furamide Formula: C28H25N3O3S MolecularWeight: 483.5814

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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=C(C=C3)NC(=O)C4=CC(=CC=C4)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)C)C

InChI

InChI=1S/C28H25N3O3S/c1-17-5-4-6-21(15-17)26(32)29-22-9-11-23(12-10-22)30-28(35)31-27(33)25-14-13-24(34-25)20-8-7-18(2)19(3)16-20/h4-16H,1-3H3,(H,29,32)(H2,30,31,33,35)