(2R)-N-(1-adamantyl)-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(1-adamantyl)-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2R)-N-(1-adamantyl)-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2R)-N-(1-adamantyl)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-(1-adamantyl)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2R)-N-(1-adamantyl)-1-tosyl-pyrrolidine-2-carboxamide Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H]2C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H30N2O3S/c1-15-4-6-19(7-5-15)28(26,27)24-8-2-3-20(24)21(25)23-22-12-16-9-17(13-22)11-18(10-16)14-22/h4-7,16-18,20H,2-3,8-14H2,1H3,(H,23,25)/t16?,17?,18?,20-,22?/m1/s1