Vitas-M small molecule compound
N-{(E)-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitrophenyl]methylidene}-4H-1,2,4-triazol-4-amine
Catalog ID
STK755546
SMILES [O-][N+](=O)c1cc(/C=N/n2cnnc2)ccc1Sc1nc2c(s1)cccc2
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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 C16H10N6O2S2 MW 382.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N6O2S2/c23-22(24)13-7-11(8-19-21-9-17-18-10-21)5-6-15(13)26-16-20-12-3-1-2-4-14(12)25-16/h1-10H/b19-8+InChIKey
VSSKTYUWPCSCEB-UFWORHAWSA-NSynonyms
(E)1(4(13benzothiazol2ylsulfanyl)3nitrophenyl)N(124triazol4yl)methanimine
(O)(N+)(=O)c1cc(C=Nn2cnnc2)ccc1Sc1nc2c(s1)cccc2
4((1E)2(124TRIAZOL4YL)2AZAVINYL)1BENZOTHIAZOL2YLTHIO2NITROBENZENE
C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)C=NN4C=NN=C4)(N+)(=O)(O)
InChI=1SC16H10N6O2S2c2322(24)13711(81921917181021)5615(13)26162012312414(12)2516h110Hb198+
MFCD00754825
N((E)(4(13benzothiazol2ylsulfanyl)3nitrophenyl)methylidene)4H124triazol4amine
ZINC000003094711
ZINC3094710
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