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

Systemtic Name: N-[(Z)-[(2R,5S)-5-methyl-2-propan-2-yl-cyclohexylidene]amino]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[(Z)-[(2R,5S)-2-isopropyl-5-methyl-cyclohexylidene]amino]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[(Z)-[(2R,5S)-5-methyl-2-propan-2-ylcyclohexylidene]amino]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-[(2R,5S)-5-methyl-2-propan-2-ylcyclohexylidene]amino]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[(Z)-[(2R,5S)-2-isopropyl-5-methyl-cyclohexylidene]amino]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C3CC(CCC3C(C)C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C\3/C[C@H](CC[C@@H]3C(C)C)C

InChI

InChI=1S/C22H30N4O2/c1-5-12-26-22(28)18-9-7-6-8-17(18)20(25-26)21(27)24-23-19-13-15(4)10-11-16(19)14(2)3/h6-9,14-16H,5,10-13H2,1-4H3,(H,24,27)/b23-19-/t15-,16+/m0/s1