Vitas-M small molecule compound

ethyl 5-{(2E)-2-[4-(propan-2-yl)benzylidene]hydrazinyl}-1,2,3-thiadiazole-4-carboxylate

Catalog ID
STL438144
SMILES CCOC(=O)c1nnsc1N/N=C/c1ccc(cc1)C(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 C15H18N4O2S MW 318.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N4O2S/c1-4-21-15(20)13-14(22-19-17-13)18-16-9-11-5-7-12(8-6-11)10(2)3/h5-10,18H,4H2,1-3H3/b16-9+
InChIKey
AFBIHOWSPZFRJG-CXUHLZMHSA-N
Synonyms

CCOC(=O)C1=C(SN=N1)NN=CC2=CC=C(C=C2)C(C)C
CCOC(=O)c1nnsc1NN=Cc1ccc(cc1)C(C)C
ethyl5((2E)2((4propan2ylphenyl)methylidene)hydrazinyl)thiadiazole4carboxylate
ethyl5((2E)2(4(propan2yl)benzylidene)hydrazinyl)123thiadiazole4carboxylate
InChI=1SC15H18N4O2Sc142115(20)1314(22191713)18169115712(8611)10(2)3h51018H4H213H3b169+
MFCD06242338
ZINC000004478095
ZINC33509466

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Available files

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