Vitas-M small molecule compound

N,N-dimethyl-4-[3-(4-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]aniline

Catalog ID
STK555117
SMILES Cc1ccc(cc1)c1nnc2n1nc(s2)c1ccc(cc1)N(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 C18H17N5S MW 335.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5S/c1-12-4-6-13(7-5-12)16-19-20-18-23(16)21-17(24-18)14-8-10-15(11-9-14)22(2)3/h4-11H,1-3H3
InChIKey
KUGKFCWPTJRUAT-UHFFFAOYSA-N
Synonyms
840509-16-2
840509162
CC1=CC=C(C=C1)C2=NN=C3N2N=C(S3)C4=CC=C(C=C4)N(C)C
DIMETHYL(4(3(4METHYLPHENYL)(124TRIAZOLO(34B)134THIADIAZOLIN6YL))PHENYL)AMINE
InChI=1SC18H17N5Sc1124613(7512)1619201823(16)2117(2418)1481015(11914)22(2)3h411H13H3
MFCD04009015
NNdimethyl4(3(4methylphenyl)(124)triazolo(34b)(134)thiadiazol6yl)aniline
NNdimethyl4(3(ptolyl)(124)triazolo(34b)(134)thiadiazol6yl)aniline
ZINC000000524093
ZINC00524093
ZINC524093

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.