Vitas-M small molecule compound

2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK849346
SMILES NC(=O)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1

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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/c1-13-7-9-14(10-8-13)22-17(11-24-15-5-3-2-4-6-15)20-21-18(22)25-12-16(19)23/h2-10H,11-12H2,1H3,(H2,19,23)
InChIKey
NOIJXKAQNKGNGU-UHFFFAOYSA-N
Synonyms
333322-48-8
2((4(4METHYLPHENYL)5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
2((4(4methylphenyl)5(phenoxymethyl)4H124triazol3yl)sulfanyl)acetamide
2((5(phenoxymethyl)4(ptolyl)4H124triazol3yl)thio)acetamide
2(4(4METHYLPHENYL)5(PHENOXYMETHYL)124TRIAZOL3YLTHIO)ACETAMIDE
2(5PHENOXYMETHYL4PTOLYL4H(124)TRIAZOL3YLSULFANYL)ACETAMIDE
333322488
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N)COC3=CC=CC=C3
InChI=1SC18H18N4O2Sc1137914(10813)2217(1124155324615)202118(22)251216(19)23h210H1112H21H3(H21923)
MFCD02229755
ZINC000000832521
ZINC00832521
ZINC832521

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Available files

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