Vitas-M small molecule compound
N-(1,3-benzothiazol-2-yl)-2-[(4-methyl-5-{[4-(propan-2-yl)phenoxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STK139945
SMILES O=C(Nc1nc2c(s1)cccc2)CSc1nnc(n1C)COc1ccc(cc1)C(C)C
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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 C22H23N5O2S2 MW 453.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O2S2/c1-14(2)15-8-10-16(11-9-15)29-12-19-25-26-22(27(19)3)30-13-20(28)24-21-23-17-6-4-5-7-18(17)31-21/h4-11,14H,12-13H2,1-3H3,(H,23,24,28)InChIKey
ZUIDUPNVWGNYLI-UHFFFAOYSA-NSynonyms
CC(C)C1=CC=C(C=C1)OCC2=NN=C(N2C)SCC(=O)NC3=NC4=CC=CC=C4S3
InChI=1SC22H23N5O2S2c114(2)1581016(11915)291219252622(27(19)3)301320(28)24212317645718(17)3121h41114H1213H213H3(H232428)
MFCD04212805
N(13BENZOTHIAZOL2YL)2((4METHYL5((4(PROPAN2YL)PHENOXY)METHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13BENZOTHIAZOL2YL)2((4METHYL5((4PROPAN2YLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002841194
ZINC02841194
ZINC2841194
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