5-[(E)-but-1-enyl]-5-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(E)-but-1-enyl]-5-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(E)-but-1-enyl]-5-methyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(E)-but-1-enyl]-5-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(E)-but-1-enyl]-5-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(E)-but-1-enyl]-5-methyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C9H12N2O2S MolecularWeight: 212.26878

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC1(C(=O)NC(=S)NC1=O)C

Isomeric SMILES

CC/C=C/C1(C(=O)NC(=S)NC1=O)C

InChI

InChI=1S/C9H12N2O2S/c1-3-4-5-9(2)6(12)10-8(14)11-7(9)13/h4-5H,3H2,1-2H3,(H2,10,11,12,13,14)/b5-4+