3-ethyl-N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-ethyl-N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[[4-(1,1-dimethylpropyl)cyclohexylidene]amino]-3-ethyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-ethyl-N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-ethyl-N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]-4-oxophthalazine-1-carboxamide Traditional Name: N-[(4-tert-amylcyclohexylidene)amino]-3-ethyl-4-keto-phthalazine-1-carboxamide Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC)CC1

Isomeric SMILES

CCC(C)(C)C1CCC(=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC)CC1

InChI

InChI=1S/C22H30N4O2/c1-5-22(3,4)15-11-13-16(14-12-15)23-24-20(27)19-17-9-7-8-10-18(17)21(28)26(6-2)25-19/h7-10,15H,5-6,11-14H2,1-4H3,(H,24,27)