5-[cyclohexyl-(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[cyclohexyl-(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[cyclohexyl-(2,5-dimethyl-1H-pyrrol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[cyclohexyl-(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[cyclohexyl-(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[cyclohexyl-(2,5-dimethyl-1H-pyrrol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C)C(=C2C(=O)NC(=S)NC2=O)C3CCCCC3

Isomeric SMILES

CC1=CC(=C(N1)C)C(=C2C(=O)NC(=S)NC2=O)C3CCCCC3

InChI

InChI=1S/C17H21N3O2S/c1-9-8-12(10(2)18-9)13(11-6-4-3-5-7-11)14-15(21)19-17(23)20-16(14)22/h8,11,18H,3-7H2,1-2H3,(H2,19,20,21,22,23)