Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide
Catalog ID
STK769873
SMILES O=C(CSc1nnc2c(n1)n(C(C)C)c1c2cccc1)NCc1ccc2c(c1)OCO2
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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 C22H21N5O3S MW 435.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O3S/c1-13(2)27-16-6-4-3-5-15(16)20-21(27)24-22(26-25-20)31-11-19(28)23-10-14-7-8-17-18(9-14)30-12-29-17/h3-9,13H,10-12H2,1-2H3,(H,23,28)InChIKey
RZEBBSRQYGSZDU-UHFFFAOYSA-NSynonyms
CC(C)N1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NCC4=CC5=C(C=C4)OCO5
InChI=1SC22H21N5O3Sc113(2)2716643515(16)2021(27)2422(262520)311119(28)231014781718(914)30122917h3913H1012H212H3(H2328)
MFCD03763773
N(13benzodioxol5ylmethyl)2((5(propan2yl)5H(124)triazino(56b)indol3yl)sulfanyl)acetamide
N(13BENZODIOXOL5YLMETHYL)2((5PROPAN2YL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETAMIDE
ZINC000008846704
ZINC08846704
ZINC8846704
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