1-(3,4-dimethylphenyl)-5-[(3-iodanyl-4-methoxy-phenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3,4-dimethylphenyl)-5-[(3-iodanyl-4-methoxy-phenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3,4-dimethylphenyl)-5-[(3-iodo-4-methoxy-phenyl)methylene]-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3,4-dimethylphenyl)-5-[(3-iodo-4-methoxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3,4-dimethylphenyl)-5-[(3-iodo-4-methoxyphenyl)methylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3,4-dimethylphenyl)-5-(3-iodo-4-methoxy-benzylidene)-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C26H21IN2O3S MolecularWeight: 568.42601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OC)I)C(=O)N(C2=S)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OC)I)C(=O)N(C2=S)C4=CC=CC=C4)C

InChI

InChI=1S/C26H21IN2O3S/c1-16-9-11-20(13-17(16)2)29-25(31)21(14-18-10-12-23(32-3)22(27)15-18)24(30)28(26(29)33)19-7-5-4-6-8-19/h4-15H,1-3H3