Vitas-M small molecule compound
1-(3-nitrophenyl)-2-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK841779
SMILES C=CCn1c(SCC(=O)c2cccc(c2)[N+](=O)[O-])nnc1c1ccncc1
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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 C18H15N5O3S MW 381.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N5O3S/c1-2-10-22-17(13-6-8-19-9-7-13)20-21-18(22)27-12-16(24)14-4-3-5-15(11-14)23(25)26/h2-9,11H,1,10,12H2InChIKey
YQECQPXFLFWMOS-UHFFFAOYSA-NSynonyms
433703-24-31(3nitrophenyl)2((4(prop2en1yl)5(pyridin4yl)4H124triazol3yl)sulfanyl)ethanone
1(3NITROPHENYL)2((4PROP2ENYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ETHANONE
1(3NITROPHENYL)2(4PROP2ENYL5(4PYRIDYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
2((4ALLYL5(PYRIDIN4YL)4H124TRIAZOL3YL)THIO)1(3NITROPHENYL)ETHANONE
433703243
C=CCN1C(=NN=C1SCC(=O)C2=CC(=CC=C2)(N+)(=O)(O))C3=CC=NC=C3
C=CCn1c(SCC(=O)c2cccc(c2)(N+)(=O)(O))nnc1c1ccncc1
InChI=1SC18H15N5O3Sc12102217(1368199713)202118(22)271216(24)1443515(1114)23(25)26h2911H11012H2
MFCD03146876
ZINC000001156148
ZINC01156148
ZINC1156148
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