5-[(2,5-dimethyl-1-pyridin-4-yl-pyrrol-3-yl)methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(2,5-dimethyl-1-pyridin-4-yl-pyrrol-3-yl)methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[2,5-dimethyl-1-(4-pyridyl)pyrrol-3-yl]methylene]-1-(4-isopropylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(2,5-dimethyl-1-pyridin-4-yl-3-pyrrolyl)methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2,5-dimethyl-1-pyridin-4-ylpyrrol-3-yl)methylidene]-1-(4-propan-2-ylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[2,5-dimethyl-1-(4-pyridyl)pyrrol-3-yl]methylene]-1-p-cumenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=NC=C2)C)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=NC=C2)C)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C25H24N4O2S/c1-15(2)18-5-7-20(8-6-18)29-24(31)22(23(30)27-25(29)32)14-19-13-16(3)28(17(19)4)21-9-11-26-12-10-21/h5-15H,1-4H3,(H,27,30,32)