Vitas-M small molecule compound
2-{[5-(morpholin-4-ylmethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-nitrophenyl)ethanone
Catalog ID
STK361576
SMILES C=CCn1c(SCC(=O)c2cccc(c2)[N+](=O)[O-])nnc1CN1CCOCC1
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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 C18H21N5O4S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N5O4S/c1-2-6-22-17(12-21-7-9-27-10-8-21)19-20-18(22)28-13-16(24)14-4-3-5-15(11-14)23(25)26/h2-5,11H,1,6-10,12-13H2InChIKey
VEYGBXAGWMZFEM-UHFFFAOYSA-NSynonyms
2((5(MORPHOLIN4YLMETHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)1(3NITROPHENYL)ETHANONE
2((5(morpholin4ylmethyl)4prop2enyl124triazol3yl)sulfanyl)1(3nitrophenyl)ethanone
C=CCN1C(=NN=C1SCC(=O)C2=CC(=CC=C2)(N+)(=O)(O))CN3CCOCC3
C=CCn1c(SCC(=O)c2cccc(c2)(N+)(=O)(O))nnc1CN1CCOCC1
InChI=1SC18H21N5O4Sc1262217(1221792710821)192018(22)281316(24)1443515(1114)23(25)26h2511H16101213H2
MFCD11852727
ZINC000023382002
ZINC23382002
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