2-(4-aminophenyl)sulfanyl-2-(2-methylimidazol-1-yl)pentanoic acid

Systemtic Name: 2-(4-aminophenyl)sulfanyl-2-(2-methylimidazol-1-yl)pentanoic acid Openeye Name: 2-(4-aminophenyl)sulfanyl-2-(2-methylimidazol-1-yl)pentanoic acid CAS Name: 2-[(4-aminophenyl)thio]-2-(2-methyl-1-imidazolyl)pentanoic acid IUPAC Name: 2-(4-aminophenyl)sulfanyl-2-(2-methylimidazol-1-yl)pentanoic acid Traditional Name: 2-[(4-aminophenyl)thio]-2-(2-methylimidazol-1-yl)valeric acid Formula: C15H19N3O2S MolecularWeight: 305.39526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)(N1C=CN=C1C)SC2=CC=C(C=C2)N

Isomeric SMILES

CCCC(C(=O)O)(N1C=CN=C1C)SC2=CC=C(C=C2)N

InChI

InChI=1S/C15H19N3O2S/c1-3-8-15(14(19)20,18-10-9-17-11(18)2)21-13-6-4-12(16)5-7-13/h4-7,9-10H,3,8,16H2,1-2H3,(H,19,20)