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

Systemtic Name: N-[(4-acetamidophenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide Openeye Name: N-[(4-acetamidophenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide CAS Name: N-[(4-acetamidoanilino)-sulfanylidenemethyl]-5-(3,4-dimethylphenyl)-2-furancarboxamide IUPAC Name: N-[(4-acetamidophenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide Traditional Name: N-[(4-acetamidophenyl)thiocarbamoyl]-5-(3,4-dimethylphenyl)-2-furamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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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)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)C)C

InChI

InChI=1S/C22H21N3O3S/c1-13-4-5-16(12-14(13)2)19-10-11-20(28-19)21(27)25-22(29)24-18-8-6-17(7-9-18)23-15(3)26/h4-12H,1-3H3,(H,23,26)(H2,24,25,27,29)