1,3-dimethyl-5-[[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1,3-dimethyl-5-[[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methylene]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 1,3-dimethyl-5-[[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methylene]-1,3-dimethyl-barbituric acid Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)C(=O)N(C1=O)C

Isomeric SMILES

CN1C(=O)C(=CC2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4)C(=O)N(C1=O)C

InChI

InChI=1S/C21H18N4O3S/c1-23-19(26)16(20(27)24(2)21(23)28)11-15-13-25(12-14-7-4-3-5-8-14)22-18(15)17-9-6-10-29-17/h3-11,13H,12H2,1-2H3