2-[(5-phenethyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[(5-phenethyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[(5-phenethyl-1,3,4-thiadiazol-2-yl)sulfanyl]thiazole-5-carboxylic acid CAS Name: 2-[(5-phenethyl-1,3,4-thiadiazol-2-yl)thio]-5-thiazolecarboxylic acid IUPAC Name: 2-[(5-phenethyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[(5-phenethyl-1,3,4-thiadiazol-2-yl)thio]thiazole-5-carboxylic acid Formula: C14H11N3O2S3 MolecularWeight: 349.45104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NN=C(S2)SC3=NC=C(S3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NN=C(S2)SC3=NC=C(S3)C(=O)O

InChI

InChI=1S/C14H11N3O2S3/c18-12(19)10-8-15-13(20-10)22-14-17-16-11(21-14)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,18,19)