3-(3-imidazol-1-ylhexanoylamino)thiophene-2-carboxylic acid

Systemtic Name: 3-(3-imidazol-1-ylhexanoylamino)thiophene-2-carboxylic acid Openeye Name: 3-(3-imidazol-1-ylhexanoylamino)thiophene-2-carboxylic acid CAS Name: 3-[[3-(1-imidazolyl)-1-oxohexyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-(3-imidazol-1-ylhexanoylamino)thiophene-2-carboxylic acid Traditional Name: 3-(3-imidazol-1-ylhexanoylamino)-2-thenoic acid Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(=O)NC1=C(SC=C1)C(=O)O)N2C=CN=C2

Isomeric SMILES

CCCC(CC(=O)NC1=C(SC=C1)C(=O)O)N2C=CN=C2

InChI

InChI=1S/C14H17N3O3S/c1-2-3-10(17-6-5-15-9-17)8-12(18)16-11-4-7-21-13(11)14(19)20/h4-7,9-10H,2-3,8H2,1H3,(H,16,18)(H,19,20)