3-[[4-[3-(cycloheptylcarbamoylamino)phenyl]phenyl]sulfonylamino]-3-phenyl-propanoic acid

Systemtic Name: 3-[[4-[3-(cycloheptylcarbamoylamino)phenyl]phenyl]sulfonylamino]-3-phenyl-propanoic acid Openeye Name: 3-[[4-[3-(cycloheptylcarbamoylamino)phenyl]phenyl]sulfonylamino]-3-phenyl-propanoic acid CAS Name: 3-[[4-[3-[[(cycloheptylamino)-oxomethyl]amino]phenyl]phenyl]sulfonylamino]-3-phenylpropanoic acid IUPAC Name: 3-[[4-[3-(cycloheptylcarbamoylamino)phenyl]phenyl]sulfonylamino]-3-phenylpropanoic acid Traditional Name: 3-[[4-[3-(cycloheptylcarbamoylamino)phenyl]phenyl]sulfonylamino]-3-phenyl-propionic acid Formula: C29H33N3O5S MolecularWeight: 535.65442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)NC2=CC=CC(=C2)C3=CC=C(C=C3)S(=O)(=O)NC(CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)NC(=O)NC2=CC=CC(=C2)C3=CC=C(C=C3)S(=O)(=O)NC(CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C29H33N3O5S/c33-28(34)20-27(22-9-4-3-5-10-22)32-38(36,37)26-17-15-21(16-18-26)23-11-8-14-25(19-23)31-29(35)30-24-12-6-1-2-7-13-24/h3-5,8-11,14-19,24,27,32H,1-2,6-7,12-13,20H2,(H,33,34)(H2,30,31,35)