Vitas-M small molecule compound
N-[(5-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1,3-benzodioxole-5-carboxamide
Catalog ID
STK230623
SMILES O=C(NC1CCCC1)CSc1nnc(n1C)CNC(=O)c1ccc2c(c1)OCO2
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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 C19H23N5O4S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N5O4S/c1-24-16(9-20-18(26)12-6-7-14-15(8-12)28-11-27-14)22-23-19(24)29-10-17(25)21-13-4-2-3-5-13/h6-8,13H,2-5,9-11H2,1H3,(H,20,26)(H,21,25)InChIKey
WYBMLMOEFLRQLE-UHFFFAOYSA-NSynonyms
BENZO(13)DIOXOLE5CARBOXYLICACID(5CYCLOPENTYLCARBAMOYLMETHYLSULFANYL4METHYL4H(124)TRIAZOL3YLMETHYL)AMIDE
CN1C(=NN=C1SCC(=O)NC2CCCC2)CNC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC19H23N5O4Sc12416(92018(26)12671415(812)28112714)222319(24)291017(25)2113423513h6813H25911H21H3(H2026)(H2125)
MFCD07790490
N((5((2(cyclopentylamino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)methyl)13benzodioxole5carboxamide
N((5(2(CYCLOPENTYLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)13BENZODIOXOLE5CARBOXAMIDE
ZINC000004736064
ZINC04736064
ZINC4736064
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