Vitas-M small molecule compound

3-[(1H-benzotriazol-1-ylmethyl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indole

Catalog ID
STK288064
SMILES c1ccc2c(c1)n(CSc1nnc3c(n1)[nH]c1c3cccc1)nn2

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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 C16H11N7S MW 333.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N7S/c1-2-6-11-10(5-1)14-15(17-11)18-16(21-20-14)24-9-23-13-8-4-3-7-12(13)19-22-23/h1-8H,9H2,(H,17,18,21)
InChIKey
LPDUJYQDQOTIPO-UHFFFAOYSA-N
Synonyms
931370-12-6
3((1HBENZOTRIAZOL1YLMETHYL)SULFANYL)5H(124)TRIAZINO(56B)INDOLE
3(benzotriazol1ylmethylsulfanyl)5H(124)triazino(56b)indole
3(BENZOTRIAZOLYLMETHYLTHIO)124TRIAZINO(56B)INDOLE
931370126
C1=CC=C2C(=C1)C3=C(N2)N=C(N=N3)SCN4C5=CC=CC=C5N=N4
c1ccc2c(c1)n(CSc1nnc3c(n1)(nH)c1c3cccc1)nn2
InChI=1SC16H11N7Sc1261110(51)1415(1711)1816(212014)2492313843712(13)192223h18H9H2(H171821)
MFCD09271155
ZINC000013943937
ZINC13943937

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Available files

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