Vitas-M small molecule compound

4-chloro-N-{[5-({2-[(2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}benzamide

Catalog ID
STK219525
SMILES COc1ccccc1NC(=O)CSc1nnc(n1C)CNC(=O)c1ccc(cc1)Cl

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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 C20H20ClN5O3S MW 445.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN5O3S/c1-26-17(11-22-19(28)13-7-9-14(21)10-8-13)24-25-20(26)30-12-18(27)23-15-5-3-4-6-16(15)29-2/h3-10H,11-12H2,1-2H3,(H,22,28)(H,23,27)
InChIKey
FDMRGAVWZFEOCR-UHFFFAOYSA-N
Synonyms

4CHLORON((5((2((2METHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)BENZAMIDE
4CHLORON((5(2(2METHOXYANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)BENZAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2OC)CNC(=O)C3=CC=C(C=C3)Cl
InChI=1SC20H20ClN5O3Sc12617(112219(28)137914(21)10813)242520(26)301218(27)2315534616(15)292h310H1112H212H3(H2228)(H2327)
MFCD07189199
ZINC000009305225
ZINC09305225
ZINC9305225

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Available files

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