Vitas-M small molecule compound

9,9-dimethyl-6-(3-nitrophenyl)-2,3,6,8,9,10-hexahydro-4H,7H-[1,3]thiazino[2,3-b]quinazoline-4,7-dione

Catalog ID
STL091279
SMILES O=C1CCSC2=NC3=C(C(N12)c1cccc(c1)[N+](=O)[O-])C(=O)CC(C3)(C)C

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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 C19H19N3O4S MW 385.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O4S/c1-19(2)9-13-16(14(23)10-19)17(11-4-3-5-12(8-11)22(25)26)21-15(24)6-7-27-18(21)20-13/h3-5,8,17H,6-7,9-10H2,1-2H3
InChIKey
GFVMCEFQHLSXMK-UHFFFAOYSA-N
Synonyms
300770-37-0
300770370
99dimethyl6(3nitrophenyl)2368910hexahydro4H7H(13)thiazino(23b)quinazoline47dione
99dimethyl6(3nitrophenyl)36810tetrahydro2H(13)thiazino(23b)quinazoline47dione
CC1(CC2=C(C(N3C(=O)CCSC3=N2)C4=CC(=CC=C4)(N+)(=O)(O))C(=O)C1)C
InChI=1SC19H19N3O4Sc119(2)91316(14(23)1019)17(1143512(811)22(25)26)2115(24)672718(21)2013h35817H67910H212H3
MFCD02166456
O=C1CCSC2=NC3=C(C(N12)c1cccc(c1)(N+)(=O)(O))C(=O)CC(C3)(C)C
ZINC000003199708
ZINC000003199709

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Available files

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