Vitas-M small molecule compound

2-{[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-naphthalen-1-ylmethylidene]acetohydrazide

Catalog ID
STK035967
SMILES O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)Cl)N/N=C/c1cccc2c1cccc2

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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 C27H20ClN5OS MW 498.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClN5OS/c28-22-15-13-20(14-16-22)26-31-32-27(33(26)23-10-2-1-3-11-23)35-18-25(34)30-29-17-21-9-6-8-19-7-4-5-12-24(19)21/h1-17H,18H2,(H,30,34)/b29-17+
InChIKey
SBMFHYCMAUFLCK-STBIYBPSSA-N
Synonyms
306757-47-1
(E)2((5(4chlorophenyl)4phenyl4H124triazol3yl)thio)N(naphthalen1ylmethylene)acetohydrazide
2((5(4CHLOROPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((E)NAPHTHALEN1YLMETHYLIDENEAMINO)ACETAMIDE
2((5(4CHLOROPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((E)NAPHTHALEN1YLMETHYLIDENE)ACETOHYDRAZIDE
306757471
C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)Cl
InChI=1SC27H20ClN5OSc2822151320(141622)26313227(33(26)23102131123)351825(34)30291721968197451224(19)21h117H18H2(H3034)b2917+
MFCD01586882
O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)Cl)NN=Cc1cccc2c1cccc2
STK035967
ZINC000002269257
ZINC33351975

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Available files

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