Vitas-M small molecule compound
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide
Catalog ID
STK079750
SMILES O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)Nc1nc2c(s1)cc(cc2)[N+](=O)[O-]
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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 C16H13N7O5S MW 415.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N7O5S/c1-20-13-12(14(25)21(2)16(20)26)22(7-17-13)6-11(24)19-15-18-9-4-3-8(23(27)28)5-10(9)29-15/h3-5,7H,6H2,1-2H3,(H,18,19,24)InChIKey
VPKPTDRWMGHRGS-UHFFFAOYSA-NSynonyms
349133-07-92(13DIMETHYL26DIOXO(137TRIHYDROPURIN7YL))N(6NITROBENZOTHIAZOL2YL)ACETAMIDE
2(13dimethyl26dioxo1236tetrahydro7Hpurin7yl)N(6nitro13benzothiazol2yl)acetamide
2(13dimethyl26dioxo23dihydro1Hpurin7(6H)yl)N(6nitrobenzo(d)thiazol2yl)acetamide
2(13DIMETHYL26DIOXOPURIN7YL)N(6NITRO13BENZOTHIAZOL2YL)ACETAMIDE
349133079
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NC3=NC4=C(S3)C=C(C=C4)(N+)(=O)(O)
InChI=1SC16H13N7O5Sc1201312(14(25)21(2)16(20)26)22(71713)611(24)1915189438(23(27)28)510(9)2915h357H6H212H3(H181924)
MFCD02006462
O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)Nc1nc2c(s1)cc(cc2)(N+)(=O)(O)
STK079750
ZINC13534283
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