5-(3,4-dimethylphenyl)-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-(3,4-dimethylphenyl)-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-(3,4-dimethylphenyl)-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]furan-2-carboxamide CAS Name: 5-(3,4-dimethylphenyl)-N-[[(4,6-dimethyl-2-pyrimidinyl)amino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(3,4-dimethylphenyl)-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-(3,4-dimethylphenyl)-N-[(4,6-dimethylpyrimidin-2-yl)thiocarbamoyl]-2-furamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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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=NC(=CC(=N3)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=O)NC(=S)NC3=NC(=CC(=N3)C)C)C

InChI

InChI=1S/C20H20N4O2S/c1-11-5-6-15(9-12(11)2)16-7-8-17(26-16)18(25)23-20(27)24-19-21-13(3)10-14(4)22-19/h5-10H,1-4H3,(H2,21,22,23,24,25,27)