3-methyl-N'-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-methyl-N'-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-methyl-N'-(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)-4-oxo-phthalazine-1-carbohydrazide CAS Name: 3-methyl-N'-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-methyl-N'-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)-4-oxophthalazine-1-carbohydrazide Traditional Name: 4-keto-3-methyl-N'-(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)phthalazine-1-carbohydrazide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C20H20N4O3S/c1-11-7-8-15-12(9-11)10-16(28-15)18(25)21-22-19(26)17-13-5-3-4-6-14(13)20(27)24(2)23-17/h3-6,10-11H,7-9H2,1-2H3,(H,21,25)(H,22,26)