Vitas-M small molecule compound

N-[(E)-(2,3-dimethoxyphenyl)methylidene]-3-(methylsulfanyl)-5-phenyl-4H-1,2,4-triazol-4-amine

Catalog ID
STK979934
SMILES COc1cccc(c1OC)/C=N/n1c(SC)nnc1c1ccccc1

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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 C18H18N4O2S MW 354.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O2S/c1-23-15-11-7-10-14(16(15)24-2)12-19-22-17(20-21-18(22)25-3)13-8-5-4-6-9-13/h4-12H,1-3H3/b19-12+
InChIKey
IWGNZSHYQVXZRH-XDHOZWIPSA-N
Synonyms

(E)1(23dimethoxyphenyl)N(3methylsulfanyl5phenyl124triazol4yl)methanimine
1(23DIMETHOXYPHENYL)N(3METHYLSULFANYL5PHENYL124TRIAZOL4YL)METHANIMINE
COC1=CC=CC(=C1OC)C=NN2C(=NN=C2SC)C3=CC=CC=C3
COc1cccc(c1OC)C=Nn1c(SC)nnc1c1ccccc1
InChI=1SC18H18N4O2Sc123151171014(16(15)242)12192217(202118(22)253)138546913h412H13H3b1912+
MFCD01177316
N((E)(23dimethoxyphenyl)methylidene)3(methylsulfanyl)5phenyl4H124triazol4amine
ZINC000001209634
ZINC33323122

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Available files

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