Vitas-M small molecule compound

4-[(E)-{2-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinylidene}methyl]benzoic acid

Catalog ID
STK052860
SMILES O=C(CSc1nc2c(s1)cccc2)N/N=C/c1ccc(cc1)C(=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 C17H13N3O3S2 MW 371.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O3S2/c21-15(10-24-17-19-13-3-1-2-4-14(13)25-17)20-18-9-11-5-7-12(8-6-11)16(22)23/h1-9H,10H2,(H,20,21)(H,22,23)/b18-9+
InChIKey
YZBPFPVZXJGRJF-GIJQJNRQSA-N
Synonyms
303105-71-7
(E)4((2(2(benzo(d)thiazol2ylthio)acetyl)hydrazono)methyl)benzoicacid
303105717
4((2(2(BENZO(D)THIAZOL2YLTHIO)ACETYL)HYDRAZONO)METHYL)BENZOICACID
4((2(BENZOTHIAZOL2YLSULFANYL)ACETYL)HYDRAZONOMETHYL)BENZOICACID
4((E)((2(13BENZOTHIAZOL2YLSULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)BENZOICACID
4((E)(2((13BENZOTHIAZOL2YLSULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)BENZOICACID
4(2((13BENZOTHIAZOL2YLSULFANYL)ACETYL)CARBOHYDRAZONOYL)BENZOICACID
C1=CC=C2C(=C1)N=C(S2)SCC(=O)NN=CC3=CC=C(C=C3)C(=O)O
InChI=1SC17H13N3O3S2c2115(1024171913312414(13)2517)20189115712(8611)16(22)23h19H10H2(H2021)(H2223)b189+
MFCD01205294
O=C(CSc1nc2c(s1)cccc2)NN=Cc1ccc(cc1)C(=O)O
STK052860
ZINC000012360453
ZINC31777348

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Available files

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