2-[2-[2-(3-cyclopentylpropanoylamino)-1,3-thiazol-4-yl]ethanoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2-[2-(3-cyclopentylpropanoylamino)-1,3-thiazol-4-yl]ethanoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-[2-(3-cyclopentylpropanoylamino)thiazol-4-yl]acetyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[2-[(3-cyclopentyl-1-oxopropyl)amino]-4-thiazolyl]-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-[2-(3-cyclopentylpropanoylamino)-1,3-thiazol-4-yl]acetyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-[2-(3-cyclopentylpropanoylamino)thiazol-4-yl]acetyl]amino]-3-phenyl-propionic acid Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)NC2=NC(=CS2)CC(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CCC(C1)CCC(=O)NC2=NC(=CS2)CC(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H27N3O4S/c26-19(11-10-15-6-4-5-7-15)25-22-23-17(14-30-22)13-20(27)24-18(21(28)29)12-16-8-2-1-3-9-16/h1-3,8-9,14-15,18H,4-7,10-13H2,(H,24,27)(H,28,29)(H,23,25,26)