Vitas-M small molecule compound
2-{[2,2-dimethyl-10-(methylsulfanyl)-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}-1-(pyrrolidin-1-yl)ethanone
Catalog ID
STL304462
SMILES CSc1nc(SCC(=O)N2CCCC2)c2c(n1)c1c(s2)nc(c2c1CC(C)(C)OC2)N1CCOCC1
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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 C25H31N5O3S3 MW 545.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O3S3/c1-25(2)12-15-16(13-33-25)21(30-8-10-32-11-9-30)27-22-18(15)19-20(36-22)23(28-24(26-19)34-3)35-14-17(31)29-6-4-5-7-29/h4-14H2,1-3H3InChIKey
GWFKNWFVNFJCKS-UHFFFAOYSA-NSynonyms
848058-75-32((22dimethyl10(methylsulfanyl)5(morpholin4yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)sulfanyl)1(pyrrolidin1yl)ethanone
2((22dimethyl10(methylthio)5morpholino24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)thio)1(pyrrolidin1yl)ethanone
848058753
CC1(CC2=C3C4=C(C(=NC(=N4)SC)SCC(=O)N5CCCC5)SC3=NC(=C2CO1)N6CCOCC6)C
InChI=1SC25H31N5O3S3c125(2)121516(133325)21(308103211930)272218(15)1920(3622)23(2824(2619)343)351417(31)29645729h414H213H3
MFCD04186816
ZINC000097954689
ZINC97954689
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