Vitas-M small molecule compound
(2E)-3-(4-nitrophenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)prop-2-enamide
Catalog ID
STK009549
SMILES O=C(Nc1nc2c(s1)CCCC2)/C=C/c1ccc(cc1)[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 C16H15N3O3S MW 329.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O3S/c20-15(10-7-11-5-8-12(9-6-11)19(21)22)18-16-17-13-3-1-2-4-14(13)23-16/h5-10H,1-4H2,(H,17,18,20)/b10-7+InChIKey
CLBGRZAGFFVSGO-JXMROGBWSA-NSynonyms
329787-33-9(2E)3(4nitrophenyl)N(4567tetrahydro13benzothiazol2yl)prop2enamide
(E)3(4nitrophenyl)N(4567tetrahydro13benzothiazol2yl)prop2enamide
329787339
C1CCC2=C(C1)N=C(S2)NC(=O)C=CC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC16H15N3O3Sc2015(107115812(9611)19(21)22)18161713312414(13)2316h510H14H2(H171820)b107+
MFCD00300859
O=C(Nc1nc2c(s1)CCCC2)C=Cc1ccc(cc1)(N+)(=O)(O)
STK009549
ZINC000000463291
ZINC00463291
ZINC463291
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