1-(3-methylbut-2-enyl)-3-(phenylmethyl)-5-(2-thiophen-2-ylethanoyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(3-methylbut-2-enyl)-3-(phenylmethyl)-5-(2-thiophen-2-ylethanoyl)-1,3-diazinane-2,4,6-trione Openeye Name: 1-benzyl-3-(3-methylbut-2-enyl)-5-[2-(2-thienyl)acetyl]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(3-methylbut-2-enyl)-5-(1-oxo-2-thiophen-2-ylethyl)-3-(phenylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 1-benzyl-3-(3-methylbut-2-enyl)-5-(2-thiophen-2-ylacetyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1-benzyl-3-(3-methylbut-2-enyl)-5-[2-(2-thienyl)acetyl]barbituric acid Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C(=O)C(C(=O)N(C1=O)CC2=CC=CC=C2)C(=O)CC3=CC=CS3)C

Isomeric SMILES

CC(=CCN1C(=O)C(C(=O)N(C1=O)CC2=CC=CC=C2)C(=O)CC3=CC=CS3)C

InChI

InChI=1S/C22H22N2O4S/c1-15(2)10-11-23-20(26)19(18(25)13-17-9-6-12-29-17)21(27)24(22(23)28)14-16-7-4-3-5-8-16/h3-10,12,19H,11,13-14H2,1-2H3