Vitas-M small molecule compound

N-[2-(3,4-diethoxyphenyl)ethyl]-2-{[4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK770402
SMILES C=CCn1c(SCC(=O)NCCc2ccc(c(c2)OCC)OCC)nnc1c1cccs1

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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 C23H28N4O3S2 MW 472.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O3S2/c1-4-13-27-22(20-8-7-14-31-20)25-26-23(27)32-16-21(28)24-12-11-17-9-10-18(29-5-2)19(15-17)30-6-3/h4,7-10,14-15H,1,5-6,11-13,16H2,2-3H3,(H,24,28)
InChIKey
WYYXCCOIHWYXQZ-UHFFFAOYSA-N
Synonyms

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NN=C(N2CC=C)C3=CC=CS3)OCC
InChI=1SC23H28N4O3S2c14132722(2087143120)252623(27)321621(28)2412111791018(2952)19(1517)3063h47101415H156111316H223H3(H2428)
MFCD03766100
N(2(34diethoxyphenyl)ethyl)2((4(prop2en1yl)5(thiophen2yl)4H124triazol3yl)sulfanyl)acetamide
N(2(34DIETHOXYPHENYL)ETHYL)2((4PROP2EN1YL5THIOPHEN2YL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2(34DIETHOXYPHENYL)ETHYL)2((4PROP2ENYL5THIOPHEN2YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000008868620
ZINC08868620
ZINC8868620

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Available files

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