Vitas-M small molecule compound

N-(4-butoxyphenyl)-2-(1H-1,2,3-triazol-5-ylsulfanyl)acetamide

Catalog ID
STK243188
SMILES CCCCOc1ccc(cc1)NC(=O)CSc1cnn[nH]1

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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 C14H18N4O2S MW 306.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N4O2S/c1-2-3-8-20-12-6-4-11(5-7-12)16-13(19)10-21-14-9-15-18-17-14/h4-7,9H,2-3,8,10H2,1H3,(H,16,19)(H,15,17,18)
InChIKey
GHLKQSSNZMCTID-UHFFFAOYSA-N
Synonyms

CCCCOC1=CC=C(C=C1)NC(=O)CSC2=NNN=C2
CCCCOc1ccc(cc1)NC(=O)CSc1cnn(nH)1
InChI=1SC14H18N4O2Sc123820126411(5712)1613(19)102114915181714h479H23810H21H3(H1619)(H151718)
MFCD07174537
N(4BUTOXYPHENYL)2(1H123TRIAZOL5YLSULFANYL)ACETAMIDE
N(4butoxyphenyl)2(2Htriazol4ylsulfanyl)acetamide
ZINC000009191718
ZINC09191718
ZINC9191718

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.