N-(1-adamantylmethyl)-2-chloranyl-5-[[2-(propan-2-ylamino)ethylamino]methyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[[2-(propan-2-ylamino)ethylamino]methyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[[2-(isopropylamino)ethylamino]methyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[[2-(propan-2-ylamino)ethylamino]methyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[[2-(propan-2-ylamino)ethylamino]methyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[[2-(isopropylamino)ethylamino]methyl]benzamide Formula: C24H36ClN3O MolecularWeight: 418.01514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCNCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)NCCNCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H36ClN3O/c1-16(2)27-6-5-26-14-17-3-4-22(25)21(10-17)23(29)28-15-24-11-18-7-19(12-24)9-20(8-18)13-24/h3-4,10,16,18-20,26-27H,5-9,11-15H2,1-2H3,(H,28,29)