Vitas-M small molecule compound
1-(1,3-dimethyl-2,6-dioxo-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-2,3,6,7-tetrahydro-1H-purin-8-yl)piperidine-4-carboxamide
Catalog ID
STL000992
SMILES NC(=O)C1CCN(CC1)c1nc2c(n1CCSc1nnnn1c1ccccc1)c(=O)n(c(=O)n2C)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 C22H26N10O3S MW 510.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N10O3S/c1-28-18-16(19(34)29(2)22(28)35)31(20(24-18)30-10-8-14(9-11-30)17(23)33)12-13-36-21-25-26-27-32(21)15-6-4-3-5-7-15/h3-7,14H,8-13H2,1-2H3,(H2,23,33)InChIKey
CZRLCIDKUPDXAW-UHFFFAOYSA-NSynonyms
476482-82-31(13dimethyl26dioxo7(2((1phenyl1Htetrazol5yl)sulfanyl)ethyl)2367tetrahydro1Hpurin8yl)piperidine4carboxamide
1(13dimethyl26dioxo7(2((1phenyl1Htetrazol5yl)thio)ethyl)2367tetrahydro1Hpurin8yl)piperidine4carboxamide
1(13DIMETHYL26DIOXO7(2(1PHENYLTETRAZOL5YL)SULFANYLETHYL)PURIN8YL)PIPERIDINE4CARBOXAMIDE
476482823
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCC(CC3)C(=O)N)CCSC4=NN=NN4C5=CC=CC=C5
InChI=1SC22H26N10O3Sc1281816(19(34)29(2)22(28)35)31(20(2418)3010814(91130)17(23)33)1213362125262732(21)156435715h3714H813H212H3(H22333)
MFCD03669480
ZINC000001898721
ZINC01898721
ZINC1898721
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