Vitas-M small molecule compound

2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)butanamide

Catalog ID
STK232499
SMILES CCC(n1cnc2c1c(=O)n(C)c(=O)n2C)C(=O)Nc1nc2c(s1)CCCC2

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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 C18H22N6O3S MW 402.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6O3S/c1-4-11(15(25)21-17-20-10-7-5-6-8-12(10)28-17)24-9-19-14-13(24)16(26)23(3)18(27)22(14)2/h9,11H,4-8H2,1-3H3,(H,20,21,25)
InChIKey
SVDZFZRTSKLOTH-UHFFFAOYSA-N
Synonyms
847853-20-7
2(13dimethyl26dioxo1236tetrahydro7Hpurin7yl)N(4567tetrahydro13benzothiazol2yl)butanamide
2(13dimethyl26dioxopurin7yl)N(4567tetrahydro13benzothiazol2yl)butanamide
847853207
CCC(C(=O)NC1=NC2=C(S1)CCCC2)N3C=NC4=C3C(=O)N(C(=O)N4C)C
InChI=1SC18H22N6O3Sc1411(15(25)21172010756812(10)2817)249191413(24)16(26)23(3)18(27)22(14)2h911H48H213H3(H202125)
MFCD07130183
ZINC000009290295
ZINC000009290298

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Available files

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