Vitas-M small molecule compound
N-{[5-({2-[(2-methoxy-5-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-3-methylbenzamide
Catalog ID
STK119818
SMILES COc1ccc(cc1NC(=O)CSc1nnc(n1C)CNC(=O)c1cccc(c1)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 C22H25N5O3S MW 439.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O3S/c1-14-6-5-7-16(10-14)21(29)23-12-19-25-26-22(27(19)3)31-13-20(28)24-17-11-15(2)8-9-18(17)30-4/h5-11H,12-13H2,1-4H3,(H,23,29)(H,24,28)InChIKey
PTSYCHMXXOHBQE-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2C)CNC(=O)C3=CC(=CC=C3)C
InChI=1SC22H25N5O3Sc11465716(1014)21(29)231219252622(27(19)3)311320(28)24171115(2)8918(17)304h511H1213H214H3(H2329)(H2428)
MFCD03721918
N((5((2((2METHOXY5METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)3METHYLBENZAMIDE
N((5(2(2METHOXY5METHYLANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)3METHYLBENZAMIDE
ZINC000001133103
ZINC01133103
ZINC1133103
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