5-(aminocarbonylamino)-2-azanyl-2-(5-chloranyl-2-phenyl-phenyl)sulfonyl-pentanoic acid

Systemtic Name: 5-(aminocarbonylamino)-2-azanyl-2-(5-chloranyl-2-phenyl-phenyl)sulfonyl-pentanoic acid Openeye Name: 2-amino-2-(5-chloro-2-phenyl-phenyl)sulfonyl-5-ureido-pentanoic acid CAS Name: 2-amino-5-(carbamoylamino)-2-(5-chloro-2-phenylphenyl)sulfonylpentanoic acid IUPAC Name: 2-amino-5-(carbamoylamino)-2-(5-chloro-2-phenylphenyl)sulfonylpentanoic acid Traditional Name: 2-amino-2-(5-chloro-2-phenyl-phenyl)sulfonyl-5-ureido-valeric acid Formula: C18H20ClN3O5S MolecularWeight: 425.8865

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=C(C=C2)Cl)S(=O)(=O)C(CCCNC(=O)N)(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=C(C=C2)Cl)S(=O)(=O)C(CCCNC(=O)N)(C(=O)O)N

InChI

InChI=1S/C18H20ClN3O5S/c19-13-7-8-14(12-5-2-1-3-6-12)15(11-13)28(26,27)18(21,16(23)24)9-4-10-22-17(20)25/h1-3,5-8,11H,4,9-10,21H2,(H,23,24)(H3,20,22,25)