Vitas-M small molecule compound
2-{4-[(4-nitrophenyl)carbonyl]piperazin-1-yl}-3-propyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL351339
SMILES CCCn1c(nc2c(c1=O)c1CCCCc1s2)N1CCN(CC1)C(=O)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 C24H27N5O4S MW 481.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O4S/c1-2-11-28-23(31)20-18-5-3-4-6-19(18)34-21(20)25-24(28)27-14-12-26(13-15-27)22(30)16-7-9-17(10-8-16)29(32)33/h7-10H,2-6,11-15H2,1H3InChIKey
JGAFQIQYLVRPOC-UHFFFAOYSA-NSynonyms
1010913-32-21010913322
2(4((4nitrophenyl)carbonyl)piperazin1yl)3propyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(4(4nitrobenzoyl)piperazin1yl)3propyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
2(4(4nitrobenzoyl)piperazin1yl)3propyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
CCCN1C(=O)C2=C(N=C1N3CCN(CC3)C(=O)C4=CC=C(C=C4)(N+)(=O)(O))SC5=C2CCCC5
CCCn1c(nc2c(c1=O)c1CCCCc1s2)N1CCN(CC1)C(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H27N5O4Sc12112823(31)2018534619(18)3421(20)2524(28)27141226(131527)22(30)167917(10816)29(32)33h710H261115H21H3
MFCD12202286
ZINC000012390780
ZINC12390780
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