Vitas-M small molecule compound
methyl 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-(4-butylphenyl)propanoate
Catalog ID
STL017880
SMILES CCCCc1ccc(cc1)CC(C(=O)OC)Sc1nnc(s1)N
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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 C16H21N3O2S2 MW 351.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O2S2/c1-3-4-5-11-6-8-12(9-7-11)10-13(14(20)21-2)22-16-19-18-15(17)23-16/h6-9,13H,3-5,10H2,1-2H3,(H2,17,18)InChIKey
IXSPMOGEDUGEAW-UHFFFAOYSA-NSynonyms
899942-25-7899942257
CCCCC1=CC=C(C=C1)CC(C(=O)OC)SC2=NN=C(S2)N
InChI=1SC16H21N3O2S2c1345116812(9711)1013(14(20)212)2216191815(17)2316h6913H3510H212H3(H21718)
methyl2((5amino134thiadiazol2yl)sulfanyl)3(4butylphenyl)propanoate
METHYL2((5AMINO134THIADIAZOL2YL)THIO)3(4BUTYLPHENYL)PROPANOATE
METHYL2(5AMINO(134THIADIAZOL2YLTHIO))3(4BUTYLPHENYL)PROPANOATE
MFCD07655029
ZINC000004483149
ZINC000004483150
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