Vitas-M small molecule compound

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

Catalog ID
STK036450
SMILES O=C(Nc1ccc(cc1)C)CSc1nnc(n1c1ccccc1)c1cccs1

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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 C21H18N4OS2 MW 406.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4OS2/c1-15-9-11-16(12-10-15)22-19(26)14-28-21-24-23-20(18-8-5-13-27-18)25(21)17-6-3-2-4-7-17/h2-13H,14H2,1H3,(H,22,26)
InChIKey
SMALZTGTKZFCDT-UHFFFAOYSA-N
Synonyms
125745-77-9
125745779
2((4phenyl5(thiophen2yl)4H124triazol3yl)thio)N(ptolyl)acetamide
CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CS4
InChI=1SC21H18N4OS2c11591116(121015)2219(26)142821242320(1885132718)25(21)176324717h213H14H21H3(H2226)
MFCD02375654
N(4METHYLPHENYL)2((4PHENYL5(THIOPHEN2YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4METHYLPHENYL)2((4PHENYL5THIOPHEN2YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4METHYLPHENYL)2(4PHENYL5(2THIENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(Nc1ccc(cc1)C)CSc1nnc(n1c1ccccc1)c1cccs1
STK036450
ZINC000000744049
ZINC00744049
ZINC744049

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.