Vitas-M small molecule compound
N-(2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-{[5-(phenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK118989
SMILES CCCCNC(=O)CSc1nc2c(s1)cc(cc2)NC(=O)CSc1nnc(n1c1ccccc1)COc1ccccc1
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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 C30H30N6O3S3 MW 618.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N6O3S3/c1-2-3-16-31-27(37)19-41-30-33-24-15-14-21(17-25(24)42-30)32-28(38)20-40-29-35-34-26(18-39-23-12-8-5-9-13-23)36(29)22-10-6-4-7-11-22/h4-15,17H,2-3,16,18-20H2,1H3,(H,31,37)(H,32,38)InChIKey
YVKSDEPKTBZXDG-UHFFFAOYSA-NSynonyms
CCCCNC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)COC5=CC=CC=C5
InChI=1SC30H30N6O3S3c123163127(37)1941303324151421(1725(24)4230)3228(38)204029353426(183923128591323)36(29)22106471122h41517H23161820H21H3(H3137)(H3238)
MFCD03236136
N(2((2(BUTYLAMINO)2OXOETHYL)SULFANYL)13BENZOTHIAZOL6YL)2((5(PHENOXYMETHYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2(2(BUTYLAMINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)2((5(PHENOXYMETHYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000008437973
ZINC08437973
ZINC8437973
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