Vitas-M small molecule compound
5-({[5-benzyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STK736475
SMILES C=CCn1c(SCC(=O)c2ccc3c(c2)n(C)c(=O)n3C)nnc1Cc1ccccc1
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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 C23H23N5O2S MW 433.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O2S/c1-4-12-28-21(13-16-8-6-5-7-9-16)24-25-22(28)31-15-20(29)17-10-11-18-19(14-17)27(3)23(30)26(18)2/h4-11,14H,1,12-13,15H2,2-3H3InChIKey
SHXLEHCRTJHZCM-UHFFFAOYSA-NSynonyms
5(((5benzyl4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)13dimethyl13dihydro2Hbenzimidazol2one
5(2((5BENZYL4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETYL)13DIMETHYLBENZIMIDAZOL2ONE
CN1C2=C(C=C(C=C2)C(=O)CSC3=NN=C(N3CC=C)CC4=CC=CC=C4)N(C1=O)C
InChI=1SC23H23N5O2Sc14122821(13168657916)242522(28)311520(29)1710111819(1417)27(3)23(30)26(18)2h41114H1121315H223H3
MFCD07397364
ZINC000012428045
ZINC12428045
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