N'-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide

Systemtic Name: N'-[(3-chloranyl-1-benzothiophen-2-yl)carbonyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide Openeye Name: N'-(3-chlorobenzothiophene-2-carbonyl)-4-oxo-3H-phthalazine-1-carbohydrazide CAS Name: N'-[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]-4-oxo-3H-phthalazine-1-carbohydrazide IUPAC Name: N'-(3-chloro-1-benzothiophene-2-carbonyl)-4-oxo-3H-phthalazine-1-carbohydrazide Traditional Name: N'-(3-chlorobenzothiophene-2-carbonyl)-4-keto-3H-phthalazine-1-carbohydrazide Formula: C18H11ClN4O3S MolecularWeight: 398.82294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NNC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NNC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C18H11ClN4O3S/c19-13-11-7-3-4-8-12(11)27-15(13)18(26)23-22-17(25)14-9-5-1-2-6-10(9)16(24)21-20-14/h1-8H,(H,21,24)(H,22,25)(H,23,26)