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

Systemtic Name: 5-[[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[1-(3,4-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[1-(3,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-(4-ethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[1-(3,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-1-(4-ethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC(=C(C=C4)C)C)C)C(=O)NC2=S

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC(=C(C=C4)C)C)C)C(=O)NC2=S

InChI

InChI=1S/C27H27N3O2S/c1-6-20-8-11-22(12-9-20)30-26(32)24(25(31)28-27(30)33)15-21-14-18(4)29(19(21)5)23-10-7-16(2)17(3)13-23/h7-15H,6H2,1-5H3,(H,28,31,33)