N-[(Z)-[(3R)-3-methylcyclohexylidene]amino]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-[(3R)-3-methylcyclohexylidene]amino]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[(3R)-3-methylcyclohexylidene]amino]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[(Z)-[(3R)-3-methylcyclohexylidene]amino]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-[(3R)-3-methylcyclohexylidene]amino]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[(Z)-[(3R)-3-methylcyclohexylidene]amino]phthalazine-1-carboxamide Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C3CCCC(C3)C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\3/CCC[C@H](C3)C

InChI

InChI=1S/C21H28N4O2/c1-3-4-7-13-25-21(27)18-12-6-5-11-17(18)19(24-25)20(26)23-22-16-10-8-9-15(2)14-16/h5-6,11-12,15H,3-4,7-10,13-14H2,1-2H3,(H,23,26)/b22-16-/t15-/m1/s1