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

Systemtic Name: N-[(4-benzamido-3-methyl-phenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide Openeye Name: N-[(4-benzamido-3-methyl-phenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide CAS Name: N-[(4-benzamido-3-methylanilino)-sulfanylidenemethyl]-5-(3,4-dimethylphenyl)-2-furancarboxamide IUPAC Name: N-[(4-benzamido-3-methylphenyl)carbamothioyl]-5-(3,4-dimethylphenyl)furan-2-carboxamide Traditional Name: N-[(4-benzamido-3-methyl-phenyl)thiocarbamoyl]-5-(3,4-dimethylphenyl)-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/c1-17-9-10-21(15-18(17)2)24-13-14-25(34-24)27(33)31-28(35)29-22-11-12-23(19(3)16-22)30-26(32)20-7-5-4-6-8-20/h4-16H,1-3H3,(H,30,32)(H2,29,31,33,35)