N-tert-butyl-2-[[3-cyclohexyl-2-[(phenylmethyl)sulfonylamino]propanoyl]amino]-3-methyl-butanamide

Systemtic Name: N-tert-butyl-2-[[3-cyclohexyl-2-[(phenylmethyl)sulfonylamino]propanoyl]amino]-3-methyl-butanamide Openeye Name: 2-[[2-(benzylsulfonylamino)-3-cyclohexyl-propanoyl]amino]-N-tert-butyl-3-methyl-butanamide CAS Name: N-tert-butyl-2-[[3-cyclohexyl-1-oxo-2-[(phenylmethyl)sulfonylamino]propyl]amino]-3-methylbutanamide IUPAC Name: 2-[[2-(benzylsulfonylamino)-3-cyclohexylpropanoyl]amino]-N-tert-butyl-3-methylbutanamide Traditional Name: 2-[[2-(benzylsulfonylamino)-3-cyclohexyl-propanoyl]amino]-N-tert-butyl-3-methyl-butyramide Formula: C25H41N3O4S MolecularWeight: 479.67574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C)(C)C)NC(=O)C(CC1CCCCC1)NS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)NC(C)(C)C)NC(=O)C(CC1CCCCC1)NS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C25H41N3O4S/c1-18(2)22(24(30)27-25(3,4)5)26-23(29)21(16-19-12-8-6-9-13-19)28-33(31,32)17-20-14-10-7-11-15-20/h7,10-11,14-15,18-19,21-22,28H,6,8-9,12-13,16-17H2,1-5H3,(H,26,29)(H,27,30)