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

Systemtic Name: 3-methyl-N-[(Z)-[(2S,5S)-5-methyl-2-propan-2-yl-cyclohexylidene]amino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[(2S,5S)-2-isopropyl-5-methyl-cyclohexylidene]amino]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[(Z)-[(2S,5S)-5-methyl-2-propan-2-ylcyclohexylidene]amino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[(Z)-[(2S,5S)-5-methyl-2-propan-2-ylcyclohexylidene]amino]-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-[(2S,5S)-2-isopropyl-5-methyl-cyclohexylidene]amino]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O2/c1-12(2)14-10-9-13(3)11-17(14)21-22-19(25)18-15-7-5-6-8-16(15)20(26)24(4)23-18/h5-8,12-14H,9-11H2,1-4H3,(H,22,25)/b21-17-/t13-,14-/m0/s1