1-(2,5-dimethylphenyl)-5-[[(phenylmethyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(2,5-dimethylphenyl)-5-[[(phenylmethyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(benzylamino)methylene]-1-(2,5-dimethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(2,5-dimethylphenyl)-5-[[(phenylmethyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(benzylamino)methylidene]-1-(2,5-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(benzylamino)methylene]-1-(2,5-dimethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C(=CNCC3=CC=CC=C3)C(=O)NC2=S

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C(=CNCC3=CC=CC=C3)C(=O)NC2=S

InChI

InChI=1S/C20H19N3O2S/c1-13-8-9-14(2)17(10-13)23-19(25)16(18(24)22-20(23)26)12-21-11-15-6-4-3-5-7-15/h3-10,12,21H,11H2,1-2H3,(H,22,24,26)