2-[[4-(4-dimethylaminophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[[4-(4-dimethylaminophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[[4-(4-dimethylaminophenyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]thiazole-5-carboxylic acid CAS Name: 2-[[4-(4-dimethylaminophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-5-thiazolecarboxylic acid IUPAC Name: 2-[[4-(4-dimethylaminophenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[[4-(4-dimethylaminophenyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]thiazole-5-carboxylic acid Formula: C18H15N5O2S3 MolecularWeight: 429.539

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N2C(=NN=C2SC3=NC=C(S3)C(=O)O)C4=CC=CS4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N2C(=NN=C2SC3=NC=C(S3)C(=O)O)C4=CC=CS4

InChI

InChI=1S/C18H15N5O2S3/c1-22(2)11-5-7-12(8-6-11)23-15(13-4-3-9-26-13)20-21-17(23)28-18-19-10-14(27-18)16(24)25/h3-10H,1-2H3,(H,24,25)