3-[4-[3-(cyclopropylcarbamoylamino)phenyl]phenyl]-2-(ethylsulfonylamino)propanoic acid

Systemtic Name: 3-[4-[3-(cyclopropylcarbamoylamino)phenyl]phenyl]-2-(ethylsulfonylamino)propanoic acid Openeye Name: 3-[4-[3-(cyclopropylcarbamoylamino)phenyl]phenyl]-2-(ethylsulfonylamino)propanoic acid CAS Name: 3-[4-[3-[[(cyclopropylamino)-oxomethyl]amino]phenyl]phenyl]-2-(ethylsulfonylamino)propanoic acid IUPAC Name: 3-[4-[3-(cyclopropylcarbamoylamino)phenyl]phenyl]-2-(ethylsulfonylamino)propanoic acid Traditional Name: 3-[4-[3-(cyclopropylcarbamoylamino)phenyl]phenyl]-2-(esylamino)propionic acid Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC(CC1=CC=C(C=C1)C2=CC(=CC=C2)NC(=O)NC3CC3)C(=O)O

Isomeric SMILES

CCS(=O)(=O)NC(CC1=CC=C(C=C1)C2=CC(=CC=C2)NC(=O)NC3CC3)C(=O)O

InChI

InChI=1S/C21H25N3O5S/c1-2-30(28,29)24-19(20(25)26)12-14-6-8-15(9-7-14)16-4-3-5-18(13-16)23-21(27)22-17-10-11-17/h3-9,13,17,19,24H,2,10-12H2,1H3,(H,25,26)(H2,22,23,27)