Vitas-M small molecule compound
N-cyclopropyl-1-{6-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide
Catalog ID
STL092873
SMILES O=C(Cn1cnc2c(c1=O)sc(n2)N1CCC(CC1)C(=O)NC1CC1)Nc1ccc2c(c1)CCC2
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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 C25H28N6O3S MW 492.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6O3S/c32-20(27-19-5-4-15-2-1-3-17(15)12-19)13-31-14-26-22-21(24(31)34)35-25(29-22)30-10-8-16(9-11-30)23(33)28-18-6-7-18/h4-5,12,14,16,18H,1-3,6-11,13H2,(H,27,32)(H,28,33)InChIKey
OCNKAFGIUVNVPW-UHFFFAOYSA-NSynonyms
C1CC2=C(C1)C=C(C=C2)NC(=O)CN3C=NC4=C(C3=O)SC(=N4)N5CCC(CC5)C(=O)NC6CC6
InChI=1SC25H28N6O3Sc3220(2719541521317(15)1219)133114262221(24(31)34)3525(2922)3010816(91130)23(33)28186718h4512141618H1361113H2(H2732)(H2833)
MFCD18787076
Ncyclopropyl1(6(2(23dihydro1Hinden5ylamino)2oxoethyl)7oxo(13)thiazolo(45d)pyrimidin2yl)piperidine4carboxamide
Ncyclopropyl1(6(2(23dihydro1Hinden5ylamino)2oxoethyl)7oxo67dihydro(13)thiazolo(45d)pyrimidin2yl)piperidine4carboxamide
ZINC000065101369
ZINC65101369
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