Vitas-M small molecule compound

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

Catalog ID
STK120182
SMILES CCCn1c2ccccc2c2c1nc(SCc1ccc(cc1)[N+](=O)[O-])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 C19H17N5O2S MW 379.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O2S/c1-2-11-23-16-6-4-3-5-15(16)17-18(23)20-19(22-21-17)27-12-13-7-9-14(10-8-13)24(25)26/h3-10H,2,11-12H2,1H3
InChIKey
QMCLNUCLCXPFEE-UHFFFAOYSA-N
Synonyms
522651-16-7
3((4NITROBENZYL)SULFANYL)5PROPYL5H(124)TRIAZINO(56B)INDOLE
3((4NITROPHENYL)METHYLSULFANYL)5PROPYL(124)TRIAZINO(56B)INDOLE
522651167
CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC4=CC=C(C=C4)(N+)(=O)(O)
CCCn1c2ccccc2c2c1nc(SCc1ccc(cc1)(N+)(=O)(O))nn2
InChI=1SC19H17N5O2Sc12112316643515(16)1718(23)2019(222117)2712137914(10813)24(25)26h310H21112H21H3
MFCD03487884
ZINC000001132372
ZINC01132372
ZINC1132372

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Available files

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