Vitas-M small molecule compound
N-(1,3-benzothiazol-2-yl)-2-{[5-(4-methoxybenzyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK139574
SMILES C=CCn1c(SCC(=O)Nc2nc3c(s2)cccc3)nnc1Cc1ccc(cc1)OC
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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 C22H21N5O2S2 MW 451.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O2S2/c1-3-12-27-19(13-15-8-10-16(29-2)11-9-15)25-26-22(27)30-14-20(28)24-21-23-17-6-4-5-7-18(17)31-21/h3-11H,1,12-14H2,2H3,(H,23,24,28)InChIKey
TZROLTSAEHFYEY-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)CC2=NN=C(N2CC=C)SCC(=O)NC3=NC4=CC=CC=C4S3
InChI=1SC22H21N5O2S2c13122719(131581016(292)11915)252622(27)301420(28)24212317645718(17)3121h311H11214H22H3(H232428)
MFCD04389450
N(13BENZOTHIAZOL2YL)2((5((4METHOXYPHENYL)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13BENZOTHIAZOL2YL)2((5(4METHOXYBENZYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000001118964
ZINC01118964
ZINC1118964
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