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

Systemtic Name: 5-[(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methylene]-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(1-ethyl-2,5-dimethyl-3-pyrrolyl)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(1-ethyl-2,5-dimethylpyrrol-3-yl)methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methylene]-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)CC)C)C(=O)NC2=S

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)CC)C)C(=O)NC2=S

InChI

InChI=1S/C21H23N3O2S/c1-5-15-7-9-17(10-8-15)24-20(26)18(19(25)22-21(24)27)12-16-11-13(3)23(6-2)14(16)4/h7-12H,5-6H2,1-4H3,(H,22,25,27)