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

Systemtic Name: 2-[2-[(4-cyclohexyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[[4-cyclohexyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[(4-cyclohexyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[(4-cyclohexyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[[4-cyclohexyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]thiazol-4-yl]acetic acid Formula: C17H18N4O2S3 MolecularWeight: 406.54542

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SC3=NC(=CS3)CC(=O)O)C4=CC=CS4

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SC3=NC(=CS3)CC(=O)O)C4=CC=CS4

InChI

InChI=1S/C17H18N4O2S3/c22-14(23)9-11-10-25-17(18-11)26-16-20-19-15(13-7-4-8-24-13)21(16)12-5-2-1-3-6-12/h4,7-8,10,12H,1-3,5-6,9H2,(H,22,23)