(5Z)-5-[(1-tert-butylpyrrol-2-yl)methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5Z)-5-[(1-tert-butylpyrrol-2-yl)methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5Z)-5-[(1-tert-butylpyrrol-2-yl)methylene]-1-(4-ethoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5Z)-5-[(1-tert-butyl-2-pyrrolyl)methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5Z)-5-[(1-tert-butylpyrrol-2-yl)methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5Z)-5-[(1-tert-butylpyrrol-2-yl)methylene]-1-p-phenetyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CN3C(C)(C)C)C(=O)NC2=S

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC=CN3C(C)(C)C)/C(=O)NC2=S

InChI

InChI=1S/C21H23N3O3S/c1-5-27-16-10-8-14(9-11-16)24-19(26)17(18(25)22-20(24)28)13-15-7-6-12-23(15)21(2,3)4/h6-13H,5H2,1-4H3,(H,22,25,28)/b17-13-