Vitas-M small molecule compound
5-[({[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetyl)amino]-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Catalog ID
STK773753
SMILES O=C(Nc1nn(nc1C(=O)N)c1ccccc1)CSc1nnnn1c1ccc(cc1C)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 C20H19N9O2S MW 449.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N9O2S/c1-12-8-9-15(13(2)10-12)28-20(23-26-27-28)32-11-16(30)22-19-17(18(21)31)24-29(25-19)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H2,21,31)(H,22,25,30)InChIKey
MJYWSRQWBFVUCP-UHFFFAOYSA-NSynonyms
5((((1(24dimethylphenyl)1Htetrazol5yl)sulfanyl)acetyl)amino)2phenyl2H123triazole4carboxamide
5((2(1(24DIMETHYLPHENYL)TETRAZOL5YL)SULFANYLACETYL)AMINO)2PHENYLTRIAZOLE4CARBOXAMIDE
CC1=CC(=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=NN(N=C3C(=O)N)C4=CC=CC=C4)C
InChI=1SC20H19N9O2Sc1128915(13(2)1012)2820(23262728)321116(30)221917(18(21)31)2429(2519)146435714h310H11H212H3(H22131)(H222530)
MFCD03855564
ZINC000012447127
ZINC12447127
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