ethyl 4-thiophen-2-yl-2-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]methylideneamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-thiophen-2-yl-2-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]methylideneamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(2-thienyl)-2-[(2,4,6-trioxohexahydropyrimidin-5-yl)methyleneamino]thiophene-3-carboxylate CAS Name: 4-thiophen-2-yl-2-[(2,4,6-trioxo-1,3-diazinan-5-yl)methylideneamino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-thiophen-2-yl-2-[(2,4,6-trioxo-1,3-diazinan-5-yl)methylideneamino]thiophene-3-carboxylate Traditional Name: 4-(2-thienyl)-2-[(2,4,6-triketohexahydropyrimidin-5-yl)methyleneamino]thiophene-3-carboxylic acid ethyl ester Formula: C16H13N3O5S2 MolecularWeight: 391.42152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CS2)N=CC3C(=O)NC(=O)NC3=O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CS2)N=CC3C(=O)NC(=O)NC3=O

InChI

InChI=1S/C16H13N3O5S2/c1-2-24-15(22)11-9(10-4-3-5-25-10)7-26-14(11)17-6-8-12(20)18-16(23)19-13(8)21/h3-8H,2H2,1H3,(H2,18,19,20,21,23)