2,4,5-trimethyl-N'-(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonyl-thieno[2,3-d]pyrimidine-6-carbohydrazide

Systemtic Name: 2,4,5-trimethyl-N'-(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonyl-thieno[2,3-d]pyrimidine-6-carbohydrazide Openeye Name: 2,4,5-trimethyl-N'-(4-oxo-3-propyl-phthalazine-1-carbonyl)thieno[2,3-d]pyrimidine-6-carbohydrazide CAS Name: 2,4,5-trimethyl-N'-[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]-6-thieno[2,3-d]pyrimidinecarbohydrazide IUPAC Name: 2,4,5-trimethyl-N'-(4-oxo-3-propylphthalazine-1-carbonyl)thieno[2,3-d]pyrimidine-6-carbohydrazide Traditional Name: N'-(4-keto-3-propyl-phthalazine-1-carbonyl)-2,4,5-trimethyl-thieno[2,3-d]pyrimidine-6-carbohydrazide Formula: C22H22N6O3S MolecularWeight: 450.51348

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=C(C4=C(N=C(N=C4S3)C)C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=C(C4=C(N=C(N=C4S3)C)C)C

InChI

InChI=1S/C22H22N6O3S/c1-5-10-28-22(31)15-9-7-6-8-14(15)17(27-28)19(29)25-26-20(30)18-11(2)16-12(3)23-13(4)24-21(16)32-18/h6-9H,5,10H2,1-4H3,(H,25,29)(H,26,30)