N-(1-adamantyl)-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]propanamide

Systemtic Name: N-(1-adamantyl)-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]propanamide Openeye Name: N-(1-adamantyl)-2-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazin-1-yl]propanamide CAS Name: N-(1-adamantyl)-2-[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1-piperazinyl]propanamide IUPAC Name: N-(1-adamantyl)-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]propanamide Traditional Name: N-(1-adamantyl)-2-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazino]propionamide Formula: C22H34N4O4S MolecularWeight: 450.59476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H34N4O4S/c1-14-20(16(3)30-24-14)31(28,29)26-6-4-25(5-7-26)15(2)21(27)23-22-11-17-8-18(12-22)10-19(9-17)13-22/h15,17-19H,4-13H2,1-3H3,(H,23,27)