Vitas-M small molecule compound
2-{[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide
Catalog ID
STL415898
SMILES O=C(Nc1cccc(c1C)C)CSc1nnc(n1C)Cc1ccc2c(c1)OCCCO2
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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 C23H26N4O3S MW 438.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O3S/c1-15-6-4-7-18(16(15)2)24-22(28)14-31-23-26-25-21(27(23)3)13-17-8-9-19-20(12-17)30-11-5-10-29-19/h4,6-9,12H,5,10-11,13-14H2,1-3H3,(H,24,28)InChIKey
LAICHFGQFGCDCX-UHFFFAOYSA-NSynonyms
2((5(34dihydro2H15benzodioxepin7ylmethyl)4methyl124triazol3yl)sulfanyl)N(23dimethylphenyl)acetamide
2((5(34dihydro2H15benzodioxepin7ylmethyl)4methyl4H124triazol3yl)sulfanyl)N(23dimethylphenyl)acetamide
CC1=C(C(=CC=C1)NC(=O)CSC2=NN=C(N2C)CC3=CC4=C(C=C3)OCCCO4)C
InChI=1SC23H26N4O3Sc11564718(16(15)2)2422(28)143123262521(27(23)3)1317891920(1217)30115102919h46912H510111314H213H3(H2428)
MFCD30706860
ZINC000101160909
ZINC101160909
Check stock
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