1-(3,4-dimethylphenyl)-5-[(furan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3,4-dimethylphenyl)-5-[(furan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3,4-dimethylphenyl)-5-[(2-furylmethylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3,4-dimethylphenyl)-5-[(2-furanylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3,4-dimethylphenyl)-5-[(furan-2-ylmethylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3,4-dimethylphenyl)-5-[(2-furfurylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CNCC3=CC=CO3)C(=O)NC2=S)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=CNCC3=CC=CO3)C(=O)NC2=S)C

InChI

InChI=1S/C18H17N3O3S/c1-11-5-6-13(8-12(11)2)21-17(23)15(16(22)20-18(21)25)10-19-9-14-4-3-7-24-14/h3-8,10,19H,9H2,1-2H3,(H,20,22,25)