2-chloranyl-N'-[(3,5-dimethyl-1-adamantyl)methyl]-N-(4-methylphenyl)sulfonyl-ethanimidamide

Systemtic Name: 2-chloranyl-N'-[(3,5-dimethyl-1-adamantyl)methyl]-N-(4-methylphenyl)sulfonyl-ethanimidamide Openeye Name: 2-chloro-N'-[(3,5-dimethyl-1-adamantyl)methyl]-N-(p-tolylsulfonyl)acetamidine CAS Name: 2-chloro-N'-[(3,5-dimethyl-1-adamantyl)methyl]-N-(4-methylphenyl)sulfonylethanimidamide IUPAC Name: 2-chloro-N'-[(3,5-dimethyl-1-adamantyl)methyl]-N-(4-methylphenyl)sulfonylethanimidamide Traditional Name: 2-chloro-N'-[(3,5-dimethyl-1-adamantyl)methyl]-N-tosyl-acetamidine Formula: C22H31ClN2O2S MolecularWeight: 423.01174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCC23CC4CC(C2)(CC(C4)(C3)C)C)CCl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=NCC23CC4CC(C2)(CC(C4)(C3)C)C)CCl

InChI

InChI=1S/C22H31ClN2O2S/c1-16-4-6-18(7-5-16)28(26,27)25-19(11-23)24-15-22-10-17-8-20(2,13-22)12-21(3,9-17)14-22/h4-7,17H,8-15H2,1-3H3,(H,24,25)