Vitas-M small molecule compound
4-{3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-4-nitrophenyl}morpholine
Catalog ID
STK148654
SMILES [O-][N+](=O)c1ccc(cc1Sc1nncn1C)N1CCOCC1
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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 C13H15N5O3S MW 321.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N5O3S/c1-16-9-14-15-13(16)22-12-8-10(2-3-11(12)18(19)20)17-4-6-21-7-5-17/h2-3,8-9H,4-7H2,1H3InChIKey
KHYPJUJAJGALLW-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1Sc1nncn1C)N1CCOCC1
2(4METHYL(124TRIAZOL3YLTHIO))4MORPHOLIN4YL1NITROBENZENE
4(3((4METHYL124TRIAZOL3YL)SULFANYL)4NITROPHENYL)MORPHOLINE
4(3((4METHYL4H124TRIAZOL3YL)SULFANYL)4NITROPHENYL)MORPHOLINE
4(3(4METHYL4H(124)TRIAZOL3YLSULFANYL)4NITROPHENYL)MORPHOLINE
CN1C=NN=C1SC2=C(C=CC(=C2)N3CCOCC3)(N+)(=O)(O)
InChI=1SC13H15N5O3Sc1169141513(16)2212810(2311(12)18(19)20)1746217517h2389H47H21H3
MFCD02153055
ZINC000004083478
ZINC04083478
ZINC4083478
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