Vitas-M small molecule compound
2-{[5-{[4-(propan-2-yl)phenoxy]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Catalog ID
STL183096
SMILES C=CCn1c(nnc1SCC(=O)Nc1nccs1)COc1ccc(cc1)C(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 C20H23N5O2S2 MW 429.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O2S2/c1-4-10-25-17(12-27-16-7-5-15(6-8-16)14(2)3)23-24-20(25)29-13-18(26)22-19-21-9-11-28-19/h4-9,11,14H,1,10,12-13H2,2-3H3,(H,21,22,26)InChIKey
AKTWZHPFDYSZPU-UHFFFAOYSA-NSynonyms
2((5((4(propan2yl)phenoxy)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(13thiazol2yl)acetamide
2((5((4PROPAN2YLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(13THIAZOL2YL)ACETAMIDE
CC(C)C1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCC(=O)NC3=NC=CS3
InChI=1SC20H23N5O2S2c14102517(1227167515(6816)14(2)3)232420(25)291318(26)2219219112819h491114H1101213H223H3(H212226)
MFCD06669501
ZINC000001107616
ZINC01107616
ZINC1107616
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