ethyl 2-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]methylideneamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl)methyleneamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl)methylideneamino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl)methylideneamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[(4,6-diketo-2-thioxo-hexahydropyrimidin-5-yl)methyleneamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H15N3O4S2 MolecularWeight: 401.4594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)N=CC3C(=O)NC(=S)NC3=O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)N=CC3C(=O)NC(=S)NC3=O

InChI

InChI=1S/C18H15N3O4S2/c1-2-25-17(24)11-8-13(10-6-4-3-5-7-10)27-16(11)19-9-12-14(22)20-18(26)21-15(12)23/h3-9,12H,2H2,1H3,(H2,20,21,22,23,26)