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

Systemtic Name: ethyl 4-[[1-ethyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]benzoate Openeye Name: ethyl 4-[(1-ethyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]benzoate CAS Name: 4-[(1-ethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1-ethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]benzoate Traditional Name: 4-[(1-ethyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]benzoic acid ethyl ester Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CNC2=CC=C(C=C2)C(=O)OCC)C(=O)NC1=S

Isomeric SMILES

CCN1C(=O)C(=CNC2=CC=C(C=C2)C(=O)OCC)C(=O)NC1=S

InChI

InChI=1S/C16H17N3O4S/c1-3-19-14(21)12(13(20)18-16(19)24)9-17-11-7-5-10(6-8-11)15(22)23-4-2/h5-9,17H,3-4H2,1-2H3,(H,18,20,24)