Vitas-M small molecule compound
2-{4-[(3-nitrophenyl)carbonyl]piperazin-1-yl}-3-propyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STL351374
SMILES CCCn1c(nc2c(c1=O)c1CCCCc1s2)N1CCN(CC1)C(=O)c1cccc(c1)[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/c1-2-10-28-23(31)20-18-8-3-4-9-19(18)34-21(20)25-24(28)27-13-11-26(12-14-27)22(30)16-6-5-7-17(15-16)29(32)33/h5-7,15H,2-4,8-14H2,1H3InChIKey
UXPUCRDTXQXQOM-UHFFFAOYSA-NSynonyms
1010910-10-71010910107
2(4((3nitrophenyl)carbonyl)piperazin1yl)3propyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(4(3nitrobenzoyl)piperazin1yl)3propyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
2(4(3nitrobenzoyl)piperazin1yl)3propyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
CCCN1C(=O)C2=C(N=C1N3CCN(CC3)C(=O)C4=CC(=CC=C4)(N+)(=O)(O))SC5=C2CCCC5
CCCn1c(nc2c(c1=O)c1CCCCc1s2)N1CCN(CC1)C(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC24H27N5O4Sc12102823(31)2018834919(18)3421(20)2524(28)27131126(121427)22(30)1665717(1516)29(32)33h5715H24814H21H3
MFCD12204825
ZINC000012409556
ZINC12409556
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