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

Systemtic Name: N-(1-adamantylmethyl)-5-[2-(2-azanylethylsulfinyl)ethoxy]-2-chloranyl-benzamide Openeye Name: N-(1-adamantylmethyl)-5-[2-(2-aminoethylsulfinyl)ethoxy]-2-chloro-benzamide CAS Name: N-(1-adamantylmethyl)-5-[2-(2-aminoethylsulfinyl)ethoxy]-2-chlorobenzamide IUPAC Name: N-(1-adamantylmethyl)-5-[2-(2-aminoethylsulfinyl)ethoxy]-2-chlorobenzamide Traditional Name: N-(1-adamantylmethyl)-5-[2-(2-aminoethylsulfinyl)ethoxy]-2-chloro-benzamide Formula: C22H31ClN2O3S MolecularWeight: 439.01114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31ClN2O3S/c23-20-2-1-18(28-4-6-29(27)5-3-24)10-19(20)21(26)25-14-22-11-15-7-16(12-22)9-17(8-15)13-22/h1-2,10,15-17H,3-9,11-14,24H2,(H,25,26)