Vitas-M small molecule compound
2,3-dimethyl-4-oxo-N-(thiophen-2-ylmethyl)-4,5-dihydrothieno[3'',2'':5',6']pyrimido[1',2':1,5]pyrrolo[2,3-b]quinoxaline-6-carboxamide
Catalog ID
STK991292
SMILES O=C(c1c2nc3ccccc3nc2n2c1[nH]c(=O)c1c2sc(c1C)C)NCc1cccs1
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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 C23H17N5O2S2 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N5O2S2/c1-11-12(2)32-23-16(11)22(30)27-19-17(21(29)24-10-13-6-5-9-31-13)18-20(28(19)23)26-15-8-4-3-7-14(15)25-18/h3-9H,10H2,1-2H3,(H,24,29)(H,27,30)InChIKey
SWDNSVYMCFWFJJ-UHFFFAOYSA-NSynonyms
23dimethyl4oxoN(thiophen2ylmethyl)45dihydrothieno(3256)pyrimido(1215)pyrrolo(23b)quinoxaline6carboxamide
CC1=C(SC2=C1C(=O)NC3=C(C4=NC5=CC=CC=C5N=C4N32)C(=O)NCC6=CC=CS6)C
InChI=1SC23H17N5O2S2c11112(2)322316(11)22(30)271917(21(29)2410136593113)1820(28(19)23)2615843714(15)2518h39H10H212H3(H2429)(H2730)
MFCD07801889
O=C(c1c2nc3ccccc3nc2n2c1(nH)c(=O)c1c2sc(c1C)C)NCc1cccs1
ZINC000006143832
ZINC06143832
ZINC6143832
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