N'-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoyl]-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide Openeye Name: N'-[2-(1-cyclopropyltetrazol-5-yl)sulfanylacetyl]-4-oxo-3-propyl-phthalazine-1-carbohydrazide CAS Name: N'-[2-[(1-cyclopropyl-5-tetrazolyl)thio]-1-oxoethyl]-4-oxo-3-propyl-1-phthalazinecarbohydrazide IUPAC Name: N'-[2-(1-cyclopropyltetrazol-5-yl)sulfanylacetyl]-4-oxo-3-propylphthalazine-1-carbohydrazide Traditional Name: N'-[2-[(1-cyclopropyltetrazol-5-yl)thio]acetyl]-4-keto-3-propyl-phthalazine-1-carbohydrazide Formula: C18H20N8O3S MolecularWeight: 428.4682

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CSC3=NN=NN3C4CC4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CSC3=NN=NN3C4CC4

InChI

InChI=1S/C18H20N8O3S/c1-2-9-25-17(29)13-6-4-3-5-12(13)15(22-25)16(28)20-19-14(27)10-30-18-21-23-24-26(18)11-7-8-11/h3-6,11H,2,7-10H2,1H3,(H,19,27)(H,20,28)