Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{[4-(4-chlorophenyl)-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL381630
SMILES O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1c1ccc(cc1)Cl)CN1CCOCC1
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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 C22H22ClN5O4S MW 487.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN5O4S/c23-15-1-4-17(5-2-15)28-20(12-27-7-9-30-10-8-27)25-26-22(28)33-13-21(29)24-16-3-6-18-19(11-16)32-14-31-18/h1-6,11H,7-10,12-14H2,(H,24,29)InChIKey
LPKUOEJHABWPTN-UHFFFAOYSA-NSynonyms
C1COCCN1CC2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC5=C(C=C4)OCO5
InChI=1SC22H22ClN5O4Sc23151417(5215)2820(1227793010827)252622(28)331321(29)2416361819(1116)32143118h1611H7101214H2(H2429)
MFCD06625417
N(13BENZODIOXOL5YL)2((4(4CHLOROPHENYL)5(MORPHOLIN4YLMETHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13benzodioxol5yl)2((4(4chlorophenyl)5(morpholin4ylmethyl)4H124triazol3yl)sulfanyl)acetamide
N13BENZODIOXOL5YL2((4(4CHLOROPHENYL)5(4MORPHOLINYLMETHYL)4H124TRIAZOL3YL)THIO)ACETAMIDE
ZINC000019799319
ZINC19799319
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