Vitas-M small molecule compound

5-[3-(4-methoxyphenyl)propyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK197731
SMILES C=CCn1c(CCCc2ccc(cc2)OC)nnc1S

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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 C15H19N3OS MW 289.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19N3OS/c1-3-11-18-14(16-17-15(18)20)6-4-5-12-7-9-13(19-2)10-8-12/h3,7-10H,1,4-6,11H2,2H3,(H,17,20)
InChIKey
XMZWNVWILBAZKD-UHFFFAOYSA-N
Synonyms
792941-81-2
3(3(4METHOXYPHENYL)PROPYL)4PROP2ENYL1H124TRIAZOLE5THIONE
4ALLYL5(3(4METHOXYPHENYL)PROPYL)
4ALLYL5(3(4METHOXYPHENYL)PROPYL)4H(124)TRIAZOLE3THIOL
5(3(4METHOXYPHENYL)PROPYL)4(PROP2EN1YL)4H124TRIAZOLE3THIOL
792941812
COC1=CC=C(C=C1)CCCC2=NNC(=S)N2CC=C
InChI=1SC15H19N3OSc13111814(161715(18)20)645127913(192)10812h3710H14611H22H3(H1720)
MFCD06665885
ZINC000004739047
ZINC04739047
ZINC4739047

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Available files

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