Vitas-M small molecule compound
2-{[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]sulfanyl}-N-(4-butoxyphenyl)acetamide
Catalog ID
STL287987
SMILES CCCCOc1ccc(cc1)NC(=O)CSCC(=O)Nc1nc2c(s1)cccc2
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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 C21H23N3O3S2 MW 429.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3S2/c1-2-3-12-27-16-10-8-15(9-11-16)22-19(25)13-28-14-20(26)24-21-23-17-6-4-5-7-18(17)29-21/h4-11H,2-3,12-14H2,1H3,(H,22,25)(H,23,24,26)InChIKey
CMOBVBXVRXXHSF-UHFFFAOYSA-NSynonyms
2((2(13benzothiazol2ylamino)2oxoethyl)sulfanyl)N(4butoxyphenyl)acetamide
2(2(13benzothiazol2ylamino)2oxoethyl)sulfanylN(4butoxyphenyl)acetamide
CCCCOC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=NC3=CC=CC=C3S2
InChI=1SC21H23N3O3S2c12312271610815(91116)2219(25)13281420(26)24212317645718(17)2921h411H231214H21H3(H2225)(H232426)
MFCD24847514
ZINC000095482033
ZINC95482033
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