Vitas-M small molecule compound

3-methyl-N-[(4-methyl-5-{[2-(naphthalen-2-ylamino)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]benzamide

Catalog ID
STK108393
SMILES O=C(Nc1ccc2c(c1)cccc2)CSc1nnc(n1C)CNC(=O)c1cccc(c1)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 C24H23N5O2S MW 445.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O2S/c1-16-6-5-9-19(12-16)23(31)25-14-21-27-28-24(29(21)2)32-15-22(30)26-20-11-10-17-7-3-4-8-18(17)13-20/h3-13H,14-15H2,1-2H3,(H,25,31)(H,26,30)
InChIKey
YFDAWABJBWNWDA-UHFFFAOYSA-N
Synonyms

2(4METHYL5(((3METHYLPHENYL)CARBONYLAMINO)METHYL)(124TRIAZOL3YLTHIO))N(2NAPHTHYL)ACETAMIDE
3METHYLN((4METHYL5((2(NAPHTHALEN2YLAMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
3METHYLN((4METHYL5(2(NAPHTHALEN2YLAMINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)METHYL)BENZAMIDE
CC1=CC=CC(=C1)C(=O)NCC2=NN=C(N2C)SCC(=O)NC3=CC4=CC=CC=C4C=C3
InChI=1SC24H23N5O2Sc11665919(1216)23(31)251421272824(29(21)2)321522(30)2620111017734818(17)1320h313H1415H212H3(H2531)(H2630)
MFCD03698814
ZINC000009763076
ZINC09763076
ZINC9763076

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Available files

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