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

Systemtic Name: 1-(3-bromophenyl)-2-sulfanylidene-5-[(1,2,5-trimethylpyrrol-3-yl)methylidene]-1,3-diazinane-4,6-dione Openeye Name: 1-(3-bromophenyl)-2-thioxo-5-[(1,2,5-trimethylpyrrol-3-yl)methylene]hexahydropyrimidine-4,6-dione CAS Name: 1-(3-bromophenyl)-2-sulfanylidene-5-[(1,2,5-trimethyl-3-pyrrolyl)methylidene]-1,3-diazinane-4,6-dione IUPAC Name: 1-(3-bromophenyl)-2-sulfanylidene-5-[(1,2,5-trimethylpyrrol-3-yl)methylidene]-1,3-diazinane-4,6-dione Traditional Name: 1-(3-bromophenyl)-2-thioxo-5-[(1,2,5-trimethylpyrrol-3-yl)methylene]hexahydropyrimidine-4,6-quinone Formula: C18H16BrN3O2S MolecularWeight: 418.30754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC(=C(N1C)C)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C18H16BrN3O2S/c1-10-7-12(11(2)21(10)3)8-15-16(23)20-18(25)22(17(15)24)14-6-4-5-13(19)9-14/h4-9H,1-3H3,(H,20,23,25)