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

Systemtic Name: ethyl 2-[[1,3-dimethyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(1,3-dimethyl-2,4,6-trioxo-hexahydropyrimidin-5-ylidene)methylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 5-phenyl-2-[(2,4,6-triketo-1,3-dimethyl-hexahydropyrimidin-5-ylidene)methylamino]thiophene-3-carboxylic acid ethyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC=C3C(=O)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC=C3C(=O)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C20H19N3O5S/c1-4-28-19(26)13-10-15(12-8-6-5-7-9-12)29-16(13)21-11-14-17(24)22(2)20(27)23(3)18(14)25/h5-11,21H,4H2,1-3H3