5-[(1-adamantylamino)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(1-adamantylamino)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(1-adamantylamino)methylene]-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(1-adamantylamino)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(1-adamantylamino)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(1-adamantylamino)methylene]-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CNC23CC4CC(C2)CC(C4)C3)C(=O)N(C1=S)C

Isomeric SMILES

CN1C(=O)C(=CNC23CC4CC(C2)CC(C4)C3)C(=O)N(C1=S)C

InChI

InChI=1S/C17H23N3O2S/c1-19-14(21)13(15(22)20(2)16(19)23)9-18-17-6-10-3-11(7-17)5-12(4-10)8-17/h9-12,18H,3-8H2,1-2H3