Vitas-M small molecule compound
N-[4-(benzyloxy)phenyl]-2-{[5-(3-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL040970
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)OCc2ccccc2)nnc1c1cccc(c1)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 C27H26N4O2S MW 470.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O2S/c1-3-16-31-26(22-11-7-8-20(2)17-22)29-30-27(31)34-19-25(32)28-23-12-14-24(15-13-23)33-18-21-9-5-4-6-10-21/h3-15,17H,1,16,18-19H2,2H3,(H,28,32)InChIKey
OSHNHMUGBNGQEA-UHFFFAOYSA-NSynonyms
849029-66-92((4allyl5(mtolyl)4H124triazol3yl)thio)N(4(benzyloxy)phenyl)acetamide
2((5(3METHYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(4PHENYLMETHOXYPHENYL)ACETAMIDE
2(5(3METHYLPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))N(4(PHENYLMETHOXY)PHENYL)ACETAMIDE
849029669
CC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4
InChI=1SC27H26N4O2Sc13163126(22117820(2)1722)293027(31)341925(32)2823121424(151323)33182195461021h31517H1161819H22H3(H2832)
MFCD05681778
N(4(benzyloxy)phenyl)2((5(3methylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
ZINC000002454049
ZINC02454049
ZINC2454049
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