N-[2-(morpholin-4-ylcarbonylamino)-3-(phenylmethyl)sulfonyl-propanoyl]-N-pentyl-1,3-benzoxazole-2-carboxamide

Systemtic Name: N-[2-(morpholin-4-ylcarbonylamino)-3-(phenylmethyl)sulfonyl-propanoyl]-N-pentyl-1,3-benzoxazole-2-carboxamide Openeye Name: N-[3-benzylsulfonyl-2-(morpholine-4-carbonylamino)propanoyl]-N-pentyl-1,3-benzoxazole-2-carboxamide CAS Name: N-[2-[[4-morpholinyl(oxo)methyl]amino]-1-oxo-3-(phenylmethyl)sulfonylpropyl]-N-pentyl-1,3-benzoxazole-2-carboxamide IUPAC Name: N-[3-benzylsulfonyl-2-(morpholine-4-carbonylamino)propanoyl]-N-pentyl-1,3-benzoxazole-2-carboxamide Traditional Name: N-amyl-N-[3-benzylsulfonyl-2-(morpholine-4-carbonylamino)propanoyl]-1,3-benzoxazole-2-carboxamide Formula: C28H34N4O7S MolecularWeight: 570.65716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C(=O)C1=NC2=CC=CC=C2O1)C(=O)C(CS(=O)(=O)CC3=CC=CC=C3)NC(=O)N4CCOCC4

Isomeric SMILES

CCCCCN(C(=O)C1=NC2=CC=CC=C2O1)C(=O)C(CS(=O)(=O)CC3=CC=CC=C3)NC(=O)N4CCOCC4

InChI

InChI=1S/C28H34N4O7S/c1-2-3-9-14-32(27(34)25-29-22-12-7-8-13-24(22)39-25)26(33)23(30-28(35)31-15-17-38-18-16-31)20-40(36,37)19-21-10-5-4-6-11-21/h4-8,10-13,23H,2-3,9,14-20H2,1H3,(H,30,35)