N-(1-adamantyl)-2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]ethanamide Openeye Name: N-(1-adamantyl)-2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]acetamide CAS Name: N-(1-adamantyl)-2-[(3,4-dimethylphenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-(1-adamantyl)-2-[(3,4-dimethylphenyl)sulfonyl-methylamino]acetamide Traditional Name: N-(1-adamantyl)-2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]acetamide Formula: C21H30N2O3S MolecularWeight: 390.5395

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NC23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NC23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C21H30N2O3S/c1-14-4-5-19(6-15(14)2)27(25,26)23(3)13-20(24)22-21-10-16-7-17(11-21)9-18(8-16)12-21/h4-6,16-18H,7-13H2,1-3H3,(H,22,24)