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

Systemtic Name: 5-[[(2,6-diethylphenyl)amino]methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(2,6-diethylanilino)methylene]-1-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(2,6-diethylanilino)methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2,6-diethylanilino)methylidene]-1-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(2,6-diethylanilino)methylene]-1-phenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H21N3O2S MolecularWeight: 379.47534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-3-14-9-8-10-15(4-2)18(14)22-13-17-19(25)23-21(27)24(20(17)26)16-11-6-5-7-12-16/h5-13,22H,3-4H2,1-2H3,(H,23,25,27)