5-hex-3-yn-2-yl-1-methyl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-hex-3-yn-2-yl-1-methyl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-allyl-1-methyl-5-(1-methylpent-2-ynyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-hex-3-yn-2-yl-1-methyl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-hex-3-yn-2-yl-1-methyl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-allyl-1-methyl-5-(1-methylpent-2-ynyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC(C)C1(C(=O)NC(=S)N(C1=O)C)CC=C

Isomeric SMILES

CCC#CC(C)C1(C(=O)NC(=S)N(C1=O)C)CC=C

InChI

InChI=1S/C14H18N2O2S/c1-5-7-8-10(3)14(9-6-2)11(17)15-13(19)16(4)12(14)18/h6,10H,2,5,9H2,1,3-4H3,(H,15,17,19)