Vitas-M small molecule compound

tert-butyl [1-(4-amino-5-sulfanyl-4H-1,2,4-triazol-3-yl)-2-phenylethyl]carbamate

Catalog ID
STL349200
SMILES O=C(OC(C)(C)C)NC(c1nnc(n1N)S)Cc1ccccc1

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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 C15H21N5O2S MW 335.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21N5O2S/c1-15(2,3)22-14(21)17-11(9-10-7-5-4-6-8-10)12-18-19-13(23)20(12)16/h4-8,11H,9,16H2,1-3H3,(H,17,21)(H,19,23)
InChIKey
WDWDHHALZXNALT-UHFFFAOYSA-N
Synonyms

(S)tertbutyl(1(4amino5mercapto4H124triazol3yl)2phenylethyl)carbamate
CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C2=NNC(=S)N2N
InChI=1SC15H21N5O2Sc115(23)2214(21)1711(9107546810)12181913(23)20(12)16h4811H916H213H3(H1721)(H1923)
MFCD28032624
O=C(OC(C)(C)C)N(C@H)(c1nnc(n1N)S)Cc1ccccc1
tertbutyl(1(4amino5sulfanyl4H124triazol3yl)2phenylethyl)carbamate
TERTBUTYL(1(4AMINO5THIOXO45DIHYDRO1H124TRIAZOL3YL)2PHENYLETHYL)CARBAMATE
TERTBUTYLN(1(4AMINO5SULFANYLIDENE1H124TRIAZOL3YL)2PHENYLETHYL)CARBAMATE
ZINC000005562177
ZINC000016007358

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Available files

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