ethyl 4-[[1,3-diethyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]benzoate

Systemtic Name: ethyl 4-[[1,3-diethyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]benzoate Openeye Name: ethyl 4-[(1,3-diethyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]benzoate CAS Name: 4-[(1,3-diethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1,3-diethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]benzoate Traditional Name: 4-[(1,3-diethyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]benzoic acid ethyl ester Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CNC2=CC=C(C=C2)C(=O)OCC)C(=O)N(C1=S)CC

Isomeric SMILES

CCN1C(=O)C(=CNC2=CC=C(C=C2)C(=O)OCC)C(=O)N(C1=S)CC

InChI

InChI=1S/C18H21N3O4S/c1-4-20-15(22)14(16(23)21(5-2)18(20)26)11-19-13-9-7-12(8-10-13)17(24)25-6-3/h7-11,19H,4-6H2,1-3H3