(phenylmethyl) 4-methylidene-6-(5-methylthiophen-2-yl)-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: (phenylmethyl) 4-methylidene-6-(5-methylthiophen-2-yl)-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: benzyl 4-methylene-6-(5-methyl-2-thienyl)-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-methylene-6-(5-methyl-2-thiophenyl)-2-oxo-1,3-diazinane-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-methylidene-6-(5-methylthiophen-2-yl)-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: 2-keto-4-methylene-6-(5-methyl-2-thienyl)hexahydropyrimidine-5-carboxylic acid benzyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2C(C(=C)NC(=O)N2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(S1)C2C(C(=C)NC(=O)N2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O3S/c1-11-8-9-14(24-11)16-15(12(2)19-18(22)20-16)17(21)23-10-13-6-4-3-5-7-13/h3-9,15-16H,2,10H2,1H3,(H2,19,20,22)