Vitas-M small molecule compound

methyl 5-{[(4-tert-butylphenyl)carbonyl]amino}-1,2,3-thiadiazole-4-carboxylate

Catalog ID
STL351709
SMILES COC(=O)c1nnsc1NC(=O)c1ccc(cc1)C(C)(C)C

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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 C15H17N3O3S MW 319.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N3O3S/c1-15(2,3)10-7-5-9(6-8-10)12(19)16-13-11(14(20)21-4)17-18-22-13/h5-8H,1-4H3,(H,16,19)
InChIKey
GAOZTSCUJZHDGS-UHFFFAOYSA-N
Synonyms
1081129-31-8
1081129318
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(N=NS2)C(=O)OC
InChI=1SC15H17N3O3Sc115(23)10759(6810)12(19)161311(14(20)214)17182213h58H14H3(H1619)
methyl5(((4tertbutylphenyl)carbonyl)amino)123thiadiazole4carboxylate
methyl5((4tertbutylbenzoyl)amino)thiadiazole4carboxylate
methyl5(4(tertbutyl)benzamido)123thiadiazole4carboxylate
MFCD12207905
ZINC000020730244
ZINC20730244

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.