Vitas-M small molecule compound

3-(3-chlorophenyl)-6-(3-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

Catalog ID
STL042896
SMILES Clc1cccc(c1)c1nnc2n1N=C(CS2)c1cccc(c1)[N+](=O)[O-]

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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 C16H10ClN5O2S MW 371.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10ClN5O2S/c17-12-5-1-4-11(7-12)15-18-19-16-21(15)20-14(9-25-16)10-3-2-6-13(8-10)22(23)24/h1-8H,9H2
InChIKey
WJSGLZZVVZZLQV-UHFFFAOYSA-N
Synonyms
713128-25-7
3(3chlorophenyl)6(3nitrophenyl)7H(124)triazolo(34b)(134)thiadiazine
3(3CHLOROPHENYL)6(3NITROPHENYL)7H124TRIAZOLO(34B)134THIADIAZINE
713128257
C1C(=NN2C(=NN=C2S1)C3=CC(=CC=C3)Cl)C4=CC(=CC=C4)(N+)(=O)(O)
Clc1cccc(c1)c1nnc2n1N=C(CS2)c1cccc(c1)(N+)(=O)(O)
InChI=1SC16H10ClN5O2Sc171251411(712)1518191621(15)2014(92516)1032613(810)22(23)24h18H9H2
MFCD05697094
ZINC000004647444
ZINC04647444
ZINC4647444

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Available files

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