Vitas-M small molecule compound
2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-[4-(diphenylmethyl)piperazin-1-yl]-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Catalog ID
STL042352
SMILES Cc1nn(c(c1)C)c1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)sc1c2CC(OC1)(C)C
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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 C33H36N6OS MW 564.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H36N6OS/c1-22-19-23(2)39(36-22)32-34-30(28-26-20-33(3,4)40-21-27(26)41-31(28)35-32)38-17-15-37(16-18-38)29(24-11-7-5-8-12-24)25-13-9-6-10-14-25/h5-14,19,29H,15-18,20-21H2,1-4H3InChIKey
BTBXKZIJLUSAPG-UHFFFAOYSA-NSynonyms
2(35dimethyl1Hpyrazol1yl)4(4(diphenylmethyl)piperazin1yl)66dimethyl58dihydro6Hpyrano(4345)thieno(23d)pyrimidine
4(4benzhydrylpiperazin1yl)2(35dimethyl1Hpyrazol1yl)66dimethyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidine
4(4benzhydrylpiperazin1yl)2(35dimethylpyrazol1yl)66dimethyl58dihydropyrano(45)thieno(12c)pyrimidine
CC1=CC(=NN1C2=NC(=C3C4=C(COC(C4)(C)C)SC3=N2)N5CCN(CC5)C(C6=CC=CC=C6)C7=CC=CC=C7)C
InChI=1SC33H36N6OSc1221923(2)39(3622)323430(28262033(34)402127(26)4131(28)3532)38171537(161838)29(24117581224)251396101425h5141929H15182021H214H3
MFCD05730619
ZINC000002604219
ZINC2604219
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