3-ethyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-ethyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-ethyl-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-ethyl-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-ethyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-ethyl-4-keto-N-(5-nosylthiazol-2-yl)phthalazine-1-carboxamide Formula: C20H15N5O6S2 MolecularWeight: 485.493

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC=C(S3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC=C(S3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N5O6S2/c1-2-24-19(27)15-6-4-3-5-14(15)17(23-24)18(26)22-20-21-11-16(32-20)33(30,31)13-9-7-12(8-10-13)25(28)29/h3-11H,2H2,1H3,(H,21,22,26)