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

Systemtic Name: 5-[(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)methylidene]-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methylene]-1-(4-methoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)methylidene]-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)methylidene]-1-(4-methoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methylene]-1-(4-methoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3S/c1-12(2)23-13(3)10-15(14(23)4)11-18-19(25)22-21(28)24(20(18)26)16-6-8-17(27-5)9-7-16/h6-12H,1-5H3,(H,22,25,28)