Vitas-M small molecule compound
7-({4-[(3-chloro-6-nitro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Catalog ID
STK483191
SMILES O=C(c1sc2c(c1Cl)ccc(c2)[N+](=O)[O-])N1CCN(CC1)Cc1cc(=O)n2c(n1)scc2
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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 C20H16ClN5O4S2 MW 489.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN5O4S2/c21-17-14-2-1-13(26(29)30)10-15(14)32-18(17)19(28)24-5-3-23(4-6-24)11-12-9-16(27)25-7-8-31-20(25)22-12/h1-2,7-10H,3-6,11H2InChIKey
QYQNAUIQVCHACA-UHFFFAOYSA-NSynonyms
7((4((3chloro6nitro1benzothiophen2yl)carbonyl)piperazin1yl)methyl)5H(13)thiazolo(32a)pyrimidin5one
7((4((3CHLORO6NITROBENZO(B)THIOPHEN2YL)CARBONYL)PIPERAZINYL)METHYL)4HYDRO13THIAZOLINO(32A)PYRIMIDIN5ONE
7((4(3chloro6nitro1benzothiophene2carbonyl)piperazin1yl)methyl)(13)thiazolo(32a)pyrimidin5one
C1CN(CCN1CC2=CC(=O)N3C=CSC3=N2)C(=O)C4=C(C5=C(S4)C=C(C=C5)(N+)(=O)(O))Cl
InChI=1SC20H16ClN5O4S2c2117142113(26(29)30)1015(14)3218(17)19(28)245323(4624)1112916(27)25783120(25)2212h12710H3611H2
MFCD06053347
O=C(c1sc2c(c1Cl)ccc(c2)(N+)(=O)(O))N1CCN(CC1)Cc1cc(=O)n2c(n1)scc2
ZINC000013323934
ZINC13323934
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