Vitas-M small molecule compound
{[4-(2,3-dimethylphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Catalog ID
STK807440
SMILES OC(=O)CSc1nnc(n1c1cccc(c1C)C)c1cccs1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H15N3O2S2 MW 345.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O2S2/c1-10-5-3-6-12(11(10)2)19-15(13-7-4-8-22-13)17-18-16(19)23-9-14(20)21/h3-8H,9H2,1-2H3,(H,20,21)InChIKey
LHZKMFZRJIUFTR-UHFFFAOYSA-NSynonyms
637325-53-2((4(23dimethylphenyl)5(thiophen2yl)4H124triazol3yl)sulfanyl)aceticacid
2((4(23DIMETHYLPHENYL)5THIOPHEN2YL124TRIAZOL3YL)SULFANYL)ACETICACID
2(4(23DIMETHYLPHENYL)5(2THIENYL)124TRIAZOL3YLTHIO)ACETICACID
637325532
CC1=C(C(=CC=C1)N2C(=NN=C2SCC(=O)O)C3=CC=CS3)C
InChI=1SC16H15N3O2S2c11053612(11(10)2)1915(137482213)171816(19)23914(20)21h38H9H212H3(H2021)
MFCD04444541
ZINC000004618198
ZINC4618198
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