4-(1-adamantyl)-N-[(2S)-5-azanyl-1-diazanyl-1-oxidanylidene-pentan-2-yl]quinoline-2-carboxamide

Systemtic Name: 4-(1-adamantyl)-N-[(2S)-5-azanyl-1-diazanyl-1-oxidanylidene-pentan-2-yl]quinoline-2-carboxamide Openeye Name: 4-(1-adamantyl)-N-[(1S)-4-amino-1-(hydrazinecarbonyl)butyl]quinoline-2-carboxamide CAS Name: 4-(1-adamantyl)-N-[(2S)-5-amino-1-hydrazinyl-1-oxopentan-2-yl]-2-quinolinecarboxamide IUPAC Name: 4-(1-adamantyl)-N-[(2S)-5-amino-1-hydrazinyl-1-oxopentan-2-yl]quinoline-2-carboxamide Traditional Name: 4-(1-adamantyl)-N-[(1S)-4-amino-1-carbazoyl-butyl]quinaldamide Formula: C25H33N5O2 MolecularWeight: 435.56182

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=NC5=CC=CC=C54)C(=O)NC(CCCN)C(=O)NN

Isomeric SMILES

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

InChI

InChI=1S/C25H33N5O2/c26-7-3-6-21(24(32)30-27)29-23(31)22-11-19(18-4-1-2-5-20(18)28-22)25-12-15-8-16(13-25)10-17(9-15)14-25/h1-2,4-5,11,15-17,21H,3,6-10,12-14,26-27H2,(H,29,31)(H,30,32)/t15?,16?,17?,21-,25?/m0/s1