N-(1-adamantylmethyl)-2-chloranyl-5-[[3-(propan-2-ylamino)propylamino]methyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[[3-(propan-2-ylamino)propylamino]methyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[[3-(isopropylamino)propylamino]methyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[[3-(propan-2-ylamino)propylamino]methyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[[3-(propan-2-ylamino)propylamino]methyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[[3-(isopropylamino)propylamino]methyl]benzamide Formula: C25H38ClN3O MolecularWeight: 432.04172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCCNCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)NCCCNCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C25H38ClN3O/c1-17(2)28-7-3-6-27-15-18-4-5-23(26)22(11-18)24(30)29-16-25-12-19-8-20(13-25)10-21(9-19)14-25/h4-5,11,17,19-21,27-28H,3,6-10,12-16H2,1-2H3,(H,29,30)