N-(2-adamantyl)-4-(2-azanyl-7-chloranyl-quinolin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-(2-adamantyl)-4-(2-azanyl-7-chloranyl-quinolin-4-yl)piperazine-1-carboxamide Openeye Name: N-(2-adamantyl)-4-(2-amino-7-chloro-4-quinolyl)piperazine-1-carboxamide CAS Name: N-(2-adamantyl)-4-(2-amino-7-chloro-4-quinolinyl)-1-piperazinecarboxamide IUPAC Name: N-(2-adamantyl)-4-(2-amino-7-chloroquinolin-4-yl)piperazine-1-carboxamide Traditional Name: N-(2-adamantyl)-4-(2-amino-7-chloro-4-quinolyl)piperazine-1-carboxamide Formula: C24H30ClN5O MolecularWeight: 439.9809

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=NC3=C2C=CC(=C3)Cl)N)C(=O)NC4C5CC6CC(C5)CC4C6

Isomeric SMILES

C1CN(CCN1C2=CC(=NC3=C2C=CC(=C3)Cl)N)C(=O)NC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C24H30ClN5O/c25-18-1-2-19-20(12-18)27-22(26)13-21(19)29-3-5-30(6-4-29)24(31)28-23-16-8-14-7-15(10-16)11-17(23)9-14/h1-2,12-17,23H,3-11H2,(H2,26,27)(H,28,31)