N-(1-adamantylmethyl)-2-chloranyl-5-[3-(2-methylsulfanylethylamino)propyl]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[3-(2-methylsulfanylethylamino)propyl]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(2-methylsulfanylethylamino)propyl]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[3-[2-(methylthio)ethylamino]propyl]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[3-(2-methylsulfanylethylamino)propyl]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[3-[2-(methylthio)ethylamino]propyl]benzamide Formula: C24H35ClN2OS MolecularWeight: 435.0655

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Descriptors Computed from Structure

Canonical SMILES:

CSCCNCCCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CSCCNCCCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H35ClN2OS/c1-29-8-7-26-6-2-3-17-4-5-22(25)21(12-17)23(28)27-16-24-13-18-9-19(14-24)11-20(10-18)15-24/h4-5,12,18-20,26H,2-3,6-11,13-16H2,1H3,(H,27,28)