1-butyl-5-[(3-imidazol-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-butyl-5-[(3-imidazol-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-butyl-5-[(3-imidazol-1-ylpropylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-butyl-5-[[3-(1-imidazolyl)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-butyl-5-[(3-imidazol-1-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-butyl-5-[(3-imidazol-1-ylpropylamino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C15H21N5O2S MolecularWeight: 335.42454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CNCCCN2C=CN=C2)C(=O)NC1=S

Isomeric SMILES

CCCCN1C(=O)C(=CNCCCN2C=CN=C2)C(=O)NC1=S

InChI

InChI=1S/C15H21N5O2S/c1-2-3-8-20-14(22)12(13(21)18-15(20)23)10-16-5-4-7-19-9-6-17-11-19/h6,9-11,16H,2-5,7-8H2,1H3,(H,18,21,23)