Vitas-M small molecule compound
N-[(5-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-4-methoxybenzamide
Catalog ID
STK211519
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1C)SCC(=O)NCc1ccccc1
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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 C21H23N5O3S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O3S/c1-26-18(13-23-20(28)16-8-10-17(29-2)11-9-16)24-25-21(26)30-14-19(27)22-12-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H,22,27)(H,23,28)InChIKey
HYRUOCKGGZRRIX-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2)CNC(=O)C3=CC=C(C=C3)OC
InChI=1SC21H23N5O3Sc12618(132320(28)1681017(292)11916)242521(26)301419(27)2212156435715h311H1214H212H3(H2227)(H2328)
MFCD08669996
N((5((2(BENZYLAMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)4METHOXYBENZAMIDE
N((5(2(BENZYLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)4METHOXYBENZAMIDE
N(5(BENZYLCARBAMOYLMETHYLSULFANYL)4METHYL4H(124)TRIAZOL3YLMETHYL)4METHOXYBENZAMIDE
ZINC000009261404
ZINC09261404
ZINC9261404
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