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

Systemtic Name: 2-[2-[(4-pyridin-3-yl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[[4-(3-pyridyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[[4-(3-pyridinyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[(4-pyridin-3-yl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[[4-(3-pyridyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]thiazol-4-yl]acetic acid Formula: C16H11N5O2S3 MolecularWeight: 401.48584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)N2C(=NN=C2SC3=NC(=CS3)CC(=O)O)C4=CC=CS4

Isomeric SMILES

C1=CC(=CN=C1)N2C(=NN=C2SC3=NC(=CS3)CC(=O)O)C4=CC=CS4

InChI

InChI=1S/C16H11N5O2S3/c22-13(23)7-10-9-25-16(18-10)26-15-20-19-14(12-4-2-6-24-12)21(15)11-3-1-5-17-8-11/h1-6,8-9H,7H2,(H,22,23)