Vitas-M small molecule compound
2-{[4-(4-chlorophenyl)-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-iodophenyl)acetamide
Catalog ID
STL381627
SMILES O=C(Nc1ccc(cc1)I)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 C21H21ClIN5O2S MW 569.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClIN5O2S/c22-15-1-7-18(8-2-15)28-19(13-27-9-11-30-12-10-27)25-26-21(28)31-14-20(29)24-17-5-3-16(23)4-6-17/h1-8H,9-14H2,(H,24,29)InChIKey
DDPYDFQZSJCFAX-UHFFFAOYSA-NSynonyms
2((4(4CHLOROPHENYL)5(MORPHOLIN4YLMETHYL)124TRIAZOL3YL)SULFANYL)N(4IODOPHENYL)ACETAMIDE
2((4(4chlorophenyl)5(morpholin4ylmethyl)4H124triazol3yl)sulfanyl)N(4iodophenyl)acetamide
C1COCCN1CC2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC=C(C=C4)I
InChI=1SC21H21ClIN5O2Sc22151718(8215)2819(132791130121027)252621(28)311420(29)24175316(23)4617h18H914H2(H2429)
MFCD06631515
ZINC000001069567
ZINC1069567
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