(2R)-2-ethyl-7-oxidanylidene-7-(1,3-thiazol-2-ylamino)heptanoic acid

Systemtic Name: (2R)-2-ethyl-7-oxidanylidene-7-(1,3-thiazol-2-ylamino)heptanoic acid Openeye Name: (2R)-2-ethyl-7-oxo-7-(thiazol-2-ylamino)heptanoic acid CAS Name: (2R)-2-ethyl-7-oxo-7-(2-thiazolylamino)heptanoic acid IUPAC Name: (2R)-2-ethyl-7-oxo-7-(1,3-thiazol-2-ylamino)heptanoic acid Traditional Name: (2R)-2-ethyl-7-keto-7-(thiazol-2-ylamino)enanthic acid Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCCC(=O)NC1=NC=CS1)C(=O)O

Isomeric SMILES

CC[C@H](CCCCC(=O)NC1=NC=CS1)C(=O)O

InChI

InChI=1S/C12H18N2O3S/c1-2-9(11(16)17)5-3-4-6-10(15)14-12-13-7-8-18-12/h7-9H,2-6H2,1H3,(H,16,17)(H,13,14,15)/t9-/m1/s1