1-methyl-2-sulfanylidene-5-[(1,2,5-trimethylpyrrol-3-yl)methylidene]-1,3-diazinane-4,6-dione

Systemtic Name: 1-methyl-2-sulfanylidene-5-[(1,2,5-trimethylpyrrol-3-yl)methylidene]-1,3-diazinane-4,6-dione Openeye Name: 1-methyl-2-thioxo-5-[(1,2,5-trimethylpyrrol-3-yl)methylene]hexahydropyrimidine-4,6-dione CAS Name: 1-methyl-2-sulfanylidene-5-[(1,2,5-trimethyl-3-pyrrolyl)methylidene]-1,3-diazinane-4,6-dione IUPAC Name: 1-methyl-2-sulfanylidene-5-[(1,2,5-trimethylpyrrol-3-yl)methylidene]-1,3-diazinane-4,6-dione Traditional Name: 1-methyl-2-thioxo-5-[(1,2,5-trimethylpyrrol-3-yl)methylene]hexahydropyrimidine-4,6-quinone Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C=C2C(=O)NC(=S)N(C2=O)C

Isomeric SMILES

CC1=CC(=C(N1C)C)C=C2C(=O)NC(=S)N(C2=O)C

InChI

InChI=1S/C13H15N3O2S/c1-7-5-9(8(2)15(7)3)6-10-11(17)14-13(19)16(4)12(10)18/h5-6H,1-4H3,(H,14,17,19)