Vitas-M small molecule compound

N-(5-chloro-2-methylphenyl)-2-{[5-methyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK343834
SMILES C=CCn1c(SCC(=O)Nc2cc(Cl)ccc2C)nnc1C

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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 C15H17ClN4OS MW 336.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17ClN4OS/c1-4-7-20-11(3)18-19-15(20)22-9-14(21)17-13-8-12(16)6-5-10(13)2/h4-6,8H,1,7,9H2,2-3H3,(H,17,21)
InChIKey
XAVOEUGSAWZHGX-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NN=C(N2CC=C)C
InChI=1SC15H17ClN4OSc1472011(3)181915(20)22914(21)1713812(16)6510(13)2h468H179H223H3(H1721)
MFCD04885505
N(5CHLORO2METHYLPHENYL)2((5METHYL4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(5CHLORO2METHYLPHENYL)2((5METHYL4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000004936525
ZINC04936525
ZINC4936525

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Available files

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