Vitas-M small molecule compound

N-(4-chloro-2-methoxy-5-methylphenyl)-2-{[5-(furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STL228823
SMILES COc1cc(Cl)c(cc1NC(=O)CSc1nnc(n1Cc1ccco1)c1ccco1)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 C21H19ClN4O4S MW 458.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN4O4S/c1-13-9-16(18(28-2)10-15(13)22)23-19(27)12-31-21-25-24-20(17-6-4-8-30-17)26(21)11-14-5-3-7-29-14/h3-10H,11-12H2,1-2H3,(H,23,27)
InChIKey
PKPXGZMZGWVPBM-UHFFFAOYSA-N
Synonyms
769134-44-3
769134443
CC1=CC(=C(C=C1Cl)OC)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CO4
InChI=1SC21H19ClN4O4Sc113916(18(282)1015(13)22)2319(27)123121252420(176483017)26(21)11145372914h310H1112H212H3(H2327)
MFCD04011308
N(4CHLORO2METHOXY5METHYLPHENYL)2((5(FURAN2YL)4(FURAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4chloro2methoxy5methylphenyl)2((5(furan2yl)4(furan2ylmethyl)4H124triazol3yl)sulfanyl)acetamide
N(4chloro2methoxy5methylphenyl)2((5(furan2yl)4(furan2ylmethyl)4H124triazol3yl)thio)acetamide
N(4CHLORO2METHOXY5METHYLPHENYL)2(5(2FURYL)4(2FURYLMETHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002374121
ZINC02374121
ZINC2374121

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Available files

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