2-methylpropyl (5S,6R)-4-methylidene-2-oxidanylidene-6-thiophen-3-yl-1,3-diazinane-5-carboxylate

Systemtic Name: 2-methylpropyl (5S,6R)-4-methylidene-2-oxidanylidene-6-thiophen-3-yl-1,3-diazinane-5-carboxylate Openeye Name: isobutyl (5S,6R)-4-methylene-2-oxo-6-(3-thienyl)hexahydropyrimidine-5-carboxylate CAS Name: (5S,6R)-4-methylene-2-oxo-6-(3-thiophenyl)-1,3-diazinane-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (5S,6R)-4-methylidene-2-oxo-6-thiophen-3-yl-1,3-diazinane-5-carboxylate Traditional Name: (5S,6R)-2-keto-4-methylene-6-(3-thienyl)hexahydropyrimidine-5-carboxylic acid isobutyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1C(NC(=O)NC1=C)C2=CSC=C2

Isomeric SMILES

CC(C)COC(=O)[C@H]1[C@@H](NC(=O)NC1=C)C2=CSC=C2

InChI

InChI=1S/C14H18N2O3S/c1-8(2)6-19-13(17)11-9(3)15-14(18)16-12(11)10-4-5-20-7-10/h4-5,7-8,11-12H,3,6H2,1-2H3,(H2,15,16,18)/t11-,12+/m1/s1