2-[2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[[4-phenethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[(4-phenethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[[4-phenethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]thiazol-4-yl]acetic acid Formula: C19H16N4O2S3 MolecularWeight: 428.55094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NN=C2SC3=NC(=CS3)CC(=O)O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NN=C2SC3=NC(=CS3)CC(=O)O)C4=CC=CS4

InChI

InChI=1S/C19H16N4O2S3/c24-16(25)11-14-12-27-19(20-14)28-18-22-21-17(15-7-4-10-26-15)23(18)9-8-13-5-2-1-3-6-13/h1-7,10,12H,8-9,11H2,(H,24,25)