Vitas-M small molecule compound

6-ethyl-6-methyl-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Catalog ID
STK757716
SMILES CCCSc1nnc2c(n1)OC(C)(CC)Nc1c2cccc1

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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 C16H20N4OS MW 316.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4OS/c1-4-10-22-15-17-14-13(19-20-15)11-8-6-7-9-12(11)18-16(3,5-2)21-14/h6-9,18H,4-5,10H2,1-3H3
InChIKey
LRULYHKIYITHMQ-UHFFFAOYSA-N
Synonyms

6ETHYL6METHYL3(PROPYLSULFANYL)67DIHYDRO(124)TRIAZINO(56D)(31)BENZOXAZEPINE
6ETHYL6METHYL3PROPYLSULFANYL7H(124)TRIAZINO(56D)(31)BENZOXAZEPINE
CCCSC1=NC2=C(C3=CC=CC=C3NC(O2)(C)CC)N=N1
InChI=1SC16H20N4OSc14102215171413(192015)11867912(11)1816(352)2114h6918H4510H213H3
MFCD01008200
ZINC000002500827
ZINC000002500828

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Available files

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