ethyl 5-phenyl-2-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-phenyl-2-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-phenyl-2-[(2,4,6-trioxohexahydropyrimidin-5-ylidene)methylamino]thiophene-3-carboxylate CAS Name: 5-phenyl-2-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-2-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]thiophene-3-carboxylate Traditional Name: 5-phenyl-2-[(2,4,6-triketohexahydropyrimidin-5-ylidene)methylamino]thiophene-3-carboxylic acid ethyl ester Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC=C3C(=O)NC(=O)NC3=O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC=C3C(=O)NC(=O)NC3=O

InChI

InChI=1S/C18H15N3O5S/c1-2-26-17(24)11-8-13(10-6-4-3-5-7-10)27-16(11)19-9-12-14(22)20-18(25)21-15(12)23/h3-9,19H,2H2,1H3,(H2,20,21,22,23,25)