N-(1-adamantylmethyl)-5-[3-(2-azanylethylsulfinyl)propoxy]-2-chloranyl-benzamide

Systemtic Name: N-(1-adamantylmethyl)-5-[3-(2-azanylethylsulfinyl)propoxy]-2-chloranyl-benzamide Openeye Name: N-(1-adamantylmethyl)-5-[3-(2-aminoethylsulfinyl)propoxy]-2-chloro-benzamide CAS Name: N-(1-adamantylmethyl)-5-[3-(2-aminoethylsulfinyl)propoxy]-2-chlorobenzamide IUPAC Name: N-(1-adamantylmethyl)-5-[3-(2-aminoethylsulfinyl)propoxy]-2-chlorobenzamide Traditional Name: N-(1-adamantylmethyl)-5-[3-(2-aminoethylsulfinyl)propoxy]-2-chloro-benzamide Formula: C23H33ClN2O3S MolecularWeight: 453.03772

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(C=CC(=C4)OCCCS(=O)CCN)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(C=CC(=C4)OCCCS(=O)CCN)Cl

InChI

InChI=1S/C23H33ClN2O3S/c24-21-3-2-19(29-5-1-6-30(28)7-4-25)11-20(21)22(27)26-15-23-12-16-8-17(13-23)10-18(9-16)14-23/h2-3,11,16-18H,1,4-10,12-15,25H2,(H,26,27)