N-[(Z)-[(2S,5S)-5-methyl-2-propan-2-yl-cyclohexylidene]amino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-[(2S,5S)-5-methyl-2-propan-2-yl-cyclohexylidene]amino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[(2S,5S)-2-isopropyl-5-methyl-cyclohexylidene]amino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(Z)-[(2S,5S)-5-methyl-2-propan-2-ylcyclohexylidene]amino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(Z)-[(2S,5S)-5-methyl-2-propan-2-ylcyclohexylidene]amino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(Z)-[(2S,5S)-2-isopropyl-5-methyl-cyclohexylidene]amino]-4-keto-3H-phthalazine-1-carboxamide Formula: C19H24N4O2 MolecularWeight: 340.41946

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=NNC(=O)C2=NNC(=O)C3=CC=CC=C32)C1)C(C)C

Isomeric SMILES

C[C@H]1CC[C@H](/C(=N\NC(=O)C2=NNC(=O)C3=CC=CC=C32)/C1)C(C)C

InChI

InChI=1S/C19H24N4O2/c1-11(2)13-9-8-12(3)10-16(13)20-23-19(25)17-14-6-4-5-7-15(14)18(24)22-21-17/h4-7,11-13H,8-10H2,1-3H3,(H,22,24)(H,23,25)/b20-16-/t12-,13-/m0/s1