Vitas-M small molecule compound
(2E)-N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enamide
Catalog ID
STK206450
SMILES O=C(Nc1cccc(c1C)c1nc2c(s1)cccc2)/C=C/c1ccc(o1)c1ccccc1[N+](=O)[O-]
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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 C27H19N3O4S MW 481.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N3O4S/c1-17-19(27-29-22-9-3-5-12-25(22)35-27)8-6-10-21(17)28-26(31)16-14-18-13-15-24(34-18)20-7-2-4-11-23(20)30(32)33/h2-16H,1H3,(H,28,31)/b16-14+InChIKey
SVNUWCJJFBMXFE-JQIJEIRASA-NSynonyms
(2E)N(3(13BENZOTHIAZOL2YL)2METHYLPHENYL)3(5(2NITROPHENYL)FURAN2YL)PROP2ENAMIDE
(E)N(3(13benzothiazol2yl)2methylphenyl)3(5(2nitrophenyl)furan2yl)prop2enamide
CC1=C(C=CC=C1NC(=O)C=CC2=CC=C(O2)C3=CC=CC=C3(N+)(=O)(O))C4=NC5=CC=CC=C5S4
InChI=1SC27H19N3O4Sc11719(2729229351225(22)3527)861021(17)2826(31)161418131524(3418)207241123(20)30(32)33h216H1H3(H2831)b1614+
MFCD06666879
O=C(Nc1cccc(c1C)c1nc2c(s1)cccc2)C=Cc1ccc(o1)c1ccccc1(N+)(=O)(O)
ZINC000009972124
ZINC09972124
ZINC9972124
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