4-(1-adamantyl)-N'-[(2S)-2,6-bis(azanyl)hexanoyl]quinoline-2-carbohydrazide

Systemtic Name: 4-(1-adamantyl)-N'-[(2S)-2,6-bis(azanyl)hexanoyl]quinoline-2-carbohydrazide Openeye Name: 4-(1-adamantyl)-N'-[(2S)-2,6-diaminohexanoyl]quinoline-2-carbohydrazide CAS Name: 4-(1-adamantyl)-N'-[(2S)-2,6-diamino-1-oxohexyl]-2-quinolinecarbohydrazide IUPAC Name: 4-(1-adamantyl)-N'-[(2S)-2,6-diaminohexanoyl]quinoline-2-carbohydrazide Traditional Name: 4-(1-adamantyl)-N'-[(2S)-2,6-diaminohexanoyl]quinaldohydrazide Formula: C26H35N5O2 MolecularWeight: 449.5884

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=NC5=CC=CC=C54)C(=O)NNC(=O)C(CCCCN)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC(=NC5=CC=CC=C54)C(=O)NNC(=O)[C@H](CCCCN)N

InChI

InChI=1S/C26H35N5O2/c27-8-4-3-6-21(28)24(32)30-31-25(33)23-12-20(19-5-1-2-7-22(19)29-23)26-13-16-9-17(14-26)11-18(10-16)15-26/h1-2,5,7,12,16-18,21H,3-4,6,8-11,13-15,27-28H2,(H,30,32)(H,31,33)/t16?,17?,18?,21-,26?/m0/s1