Vitas-M small molecule compound
methyl 5-({[2,2-dimethyl-5-(pyrrolidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}methyl)furan-2-carboxylate
Catalog ID
STL241334
SMILES COC(=O)c1ccc(o1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCCC1
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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 C25H26N4O4S2 MW 510.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O4S2/c1-25(2)10-15-16(11-32-25)21(29-8-4-5-9-29)28-22-18(15)19-20(35-22)23(27-13-26-19)34-12-14-6-7-17(33-14)24(30)31-3/h6-7,13H,4-5,8-12H2,1-3H3InChIKey
XSTUGARCHLONDZ-UHFFFAOYSA-NSynonyms
799816-20-9799816209
CC1(CC2=C3C4=C(C(=NC=N4)SCC5=CC=C(O5)C(=O)OC)SC3=NC(=C2CO1)N6CCCC6)C
InChI=1SC25H26N4O4S2c125(2)101516(113225)21(29845929)282218(15)1920(3522)23(27132619)3412146717(3314)24(30)313h6713H45812H213H3
methyl5(((22dimethyl5(pyrrolidin1yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)methyl)furan2carboxylate
methyl5(((22dimethyl5(pyrrolidin1yl)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)methyl)furan2carboxylate
MFCD03680808
ZINC000020189921
ZINC20189921
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