4-[(5Z)-5-[(5-methylthiophen-2-yl)methylidene]-2,4,6-tris(oxidanylidene)-1,3-diazinan-1-yl]benzoate

Systemtic Name: 4-[(5Z)-5-[(5-methylthiophen-2-yl)methylidene]-2,4,6-tris(oxidanylidene)-1,3-diazinan-1-yl]benzoate Openeye Name: 4-[(5Z)-5-[(5-methyl-2-thienyl)methylene]-2,4,6-trioxo-hexahydropyrimidin-1-yl]benzoate CAS Name: 4-[(5Z)-5-[(5-methyl-2-thiophenyl)methylidene]-2,4,6-trioxo-1,3-diazinan-1-yl]benzoate IUPAC Name: 4-[(5Z)-5-[(5-methylthiophen-2-yl)methylidene]-2,4,6-trioxo-1,3-diazinan-1-yl]benzoate Traditional Name: 4-[(5Z)-2,4,6-triketo-5-[(5-methyl-2-thienyl)methylene]hexahydropyrimidin-1-yl]benzoate Formula: C17H11N2O5S- MolecularWeight: 355.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)/C=C\2/C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C17H12N2O5S/c1-9-2-7-12(25-9)8-13-14(20)18-17(24)19(15(13)21)11-5-3-10(4-6-11)16(22)23/h2-8H,1H3,(H,22,23)(H,18,20,24)/p-1/b13-8-