N-[1-(1,3-benzoxazol-2-yl)-1-oxidanylidene-pentan-2-yl]-2-(cyclohexylmethyl)-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-[1-(1,3-benzoxazol-2-yl)-1-oxidanylidene-pentan-2-yl]-2-(cyclohexylmethyl)-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: N-[1-(1,3-benzoxazole-2-carbonyl)butyl]-2-(benzylsulfonylmethyl)-3-cyclohexyl-propanamide CAS Name: N-[1-(1,3-benzoxazol-2-yl)-1-oxopentan-2-yl]-2-(cyclohexylmethyl)-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: N-[1-(1,3-benzoxazol-2-yl)-1-oxopentan-2-yl]-2-(benzylsulfonylmethyl)-3-cyclohexylpropanamide Traditional Name: N-[1-(1,3-benzoxazole-2-carbonyl)butyl]-2-(benzylsulfonylmethyl)-3-cyclohexyl-propionamide Formula: C29H36N2O5S MolecularWeight: 524.67154

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C1=NC2=CC=CC=C2O1)NC(=O)C(CC3CCCCC3)CS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CCCC(C(=O)C1=NC2=CC=CC=C2O1)NC(=O)C(CC3CCCCC3)CS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C29H36N2O5S/c1-2-11-25(27(32)29-31-24-16-9-10-17-26(24)36-29)30-28(33)23(18-21-12-5-3-6-13-21)20-37(34,35)19-22-14-7-4-8-15-22/h4,7-10,14-17,21,23,25H,2-3,5-6,11-13,18-20H2,1H3,(H,30,33)