N-(1-adamantylmethyl)-3-[(4-ethanoylphenyl)sulfonylamino]propanamide

Systemtic Name: N-(1-adamantylmethyl)-3-[(4-ethanoylphenyl)sulfonylamino]propanamide Openeye Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1-adamantylmethyl)propanamide CAS Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1-adamantylmethyl)propanamide IUPAC Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1-adamantylmethyl)propanamide Traditional Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1-adamantylmethyl)propionamide Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H30N2O4S/c1-15(25)19-2-4-20(5-3-19)29(27,28)24-7-6-21(26)23-14-22-11-16-8-17(12-22)10-18(9-16)13-22/h2-5,16-18,24H,6-14H2,1H3,(H,23,26)