Vitas-M small molecule compound
N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)butanamide
Catalog ID
STL477096
SMILES CCC(C(=O)Nc1nc2c(s1)CCCC2)Sc1nnc2c(n1)[nH]c1c2cccc1
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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 C20H20N6OS2 MW 424.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N6OS2/c1-2-14(18(27)24-19-22-13-9-5-6-10-15(13)29-19)28-20-23-17-16(25-26-20)11-7-3-4-8-12(11)21-17/h3-4,7-8,14H,2,5-6,9-10H2,1H3,(H,21,23,26)(H,22,24,27)InChIKey
DQCMJLRAMMNJLJ-UHFFFAOYSA-NSynonyms
522650-97-1522650971
CCC(C(=O)NC1=NC2=C(S1)CCCC2)SC3=NC4=C(C5=CC=CC=C5N4)N=N3
CCC(C(=O)Nc1nc2c(s1)CCCC2)Sc1nnc2c(n1)(nH)c1c2cccc1
InChI=1SC20H20N6OS2c1214(18(27)241922139561015(13)2919)2820231716(252620)11734812(11)2117h347814H256910H21H3(H212326)(H222427)
MFCD03487865
N(4567tetrahydro13benzothiazol2yl)2(5H(124)triazino(56b)indol3ylsulfanyl)butanamide
ZINC000002746237
ZINC000002746238
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