Vitas-M small molecule compound
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(naphthalen-2-yl)ethylidene]acetohydrazide
Catalog ID
STK039213
SMILES COc1ccc(cc1OC)c1nnc(n1c1ccccc1)SCC(=O)N/N=C(/c1ccc2c(c1)cccc2)\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 C30H27N5O3S MW 537.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N5O3S/c1-20(22-14-13-21-9-7-8-10-23(21)17-22)31-32-28(36)19-39-30-34-33-29(35(30)25-11-5-4-6-12-25)24-15-16-26(37-2)27(18-24)38-3/h4-18H,19H2,1-3H3,(H,32,36)/b31-20+InChIKey
SLMBUBZMJSAFLY-AJBULDERSA-NSynonyms
(Z)2((5(34dimethoxyphenyl)4phenyl4H124triazol3yl)thio)N(1(naphthalen2yl)ethylidene)acetohydrazide
2((5(34dimethoxyphenyl)4phenyl124triazol3yl)sulfanyl)N((E)1naphthalen2ylethylideneamino)acetamide
2((5(34DIMETHOXYPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((1E)1(NAPHTHALEN2YL)ETHYLIDENE)ACETOHYDRAZIDE
CC(=NNC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC(=C(C=C3)OC)OC)C4=CC5=CC=CC=C5C=C4
COc1ccc(cc1OC)c1nnc(n1c1ccccc1)SCC(=O)NN=C(c1ccc2c(c1)cccc2)C
InChI=1SC30H27N5O3Sc120(221413219781023(21)1722)313228(36)193930343329(35(30)25115461225)24151626(372)27(1824)383h418H19H213H3(H3236)b3120+
MFCD02076775
STK039213
ZINC000100611915
ZINC100875296
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