5-(butylaminomethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-(butylaminomethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(butylaminomethylene)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(butylaminomethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(butylaminomethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(butylaminomethylene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C9H13N3O2S MolecularWeight: 227.28342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC=C1C(=O)NC(=S)NC1=O

Isomeric SMILES

CCCCNC=C1C(=O)NC(=S)NC1=O

InChI

InChI=1S/C9H13N3O2S/c1-2-3-4-10-5-6-7(13)11-9(15)12-8(6)14/h5,10H,2-4H2,1H3,(H2,11,12,13,14,15)