(2S)-2-[(5-acetamido-2-methoxy-phenyl)sulfonylamino]-N-cycloheptyl-3-phenyl-propanamide

Systemtic Name: (2S)-2-[(5-acetamido-2-methoxy-phenyl)sulfonylamino]-N-cycloheptyl-3-phenyl-propanamide Openeye Name: (2S)-2-[(5-acetamido-2-methoxy-phenyl)sulfonylamino]-N-cycloheptyl-3-phenyl-propanamide CAS Name: (2S)-2-[(5-acetamido-2-methoxyphenyl)sulfonylamino]-N-cycloheptyl-3-phenylpropanamide IUPAC Name: (2S)-2-[(5-acetamido-2-methoxyphenyl)sulfonylamino]-N-cycloheptyl-3-phenylpropanamide Traditional Name: (2S)-2-[(5-acetamido-2-methoxy-phenyl)sulfonylamino]-N-cycloheptyl-3-phenyl-propionamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NC3CCCCCC3

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NC3CCCCCC3

InChI

InChI=1S/C25H33N3O5S/c1-18(29)26-21-14-15-23(33-2)24(17-21)34(31,32)28-22(16-19-10-6-5-7-11-19)25(30)27-20-12-8-3-4-9-13-20/h5-7,10-11,14-15,17,20,22,28H,3-4,8-9,12-13,16H2,1-2H3,(H,26,29)(H,27,30)/t22-/m0/s1