2-(4-chlorophenyl)sulfanylethyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 2-(4-chlorophenyl)sulfanylethyl 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid 2-[(4-chlorophenyl)thio]ethyl ester IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid 2-[(4-chlorophenyl)thio]ethyl ester Formula: C19H17ClN2O3S MolecularWeight: 388.86788

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H17ClN2O3S/c1-2-22-18(23)16-6-4-3-5-15(16)17(21-22)19(24)25-11-12-26-14-9-7-13(20)8-10-14/h3-10H,2,11-12H2,1H3