2-(1H-imidazol-5-ylmethylamino)-2-(thiophen-2-ylmethyl)hexanoic acid

Systemtic Name: 2-(1H-imidazol-5-ylmethylamino)-2-(thiophen-2-ylmethyl)hexanoic acid Openeye Name: 2-(1H-imidazol-5-ylmethylamino)-2-(2-thienylmethyl)hexanoic acid CAS Name: 2-(1H-imidazol-5-ylmethylamino)-2-(thiophen-2-ylmethyl)hexanoic acid IUPAC Name: 2-(1H-imidazol-5-ylmethylamino)-2-(thiophen-2-ylmethyl)hexanoic acid Traditional Name: 2-(1H-imidazol-5-ylmethylamino)-2-(2-thenyl)hexanoic acid Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1=CC=CS1)(C(=O)O)NCC2=CN=CN2

Isomeric SMILES

CCCCC(CC1=CC=CS1)(C(=O)O)NCC2=CN=CN2

InChI

InChI=1S/C15H21N3O2S/c1-2-3-6-15(14(19)20,8-13-5-4-7-21-13)18-10-12-9-16-11-17-12/h4-5,7,9,11,18H,2-3,6,8,10H2,1H3,(H,16,17)(H,19,20)