Vitas-M small molecule compound
1-[3-(methylsulfanyl)phenyl]-5-oxo-N-[3-(4H-1,2,4-triazol-3-yl)phenyl]pyrrolidine-3-carboxamide
Catalog ID
STL423179
SMILES CSc1cccc(c1)N1CC(CC1=O)C(=O)Nc1cccc(c1)c1nnc[nH]1
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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 C20H19N5O2S MW 393.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O2S/c1-28-17-7-3-6-16(10-17)25-11-14(9-18(25)26)20(27)23-15-5-2-4-13(8-15)19-21-12-22-24-19/h2-8,10,12,14H,9,11H2,1H3,(H,23,27)(H,21,22,24)InChIKey
QMTWJHNBDGAWHB-UHFFFAOYSA-NSynonyms
1630861-16-31(3(methylsulfanyl)phenyl)5oxoN(3(4H124triazol3yl)phenyl)pyrrolidine3carboxamide
1(3methylsulfanylphenyl)5oxoN(3(1H124triazol5yl)phenyl)pyrrolidine3carboxamide
1630861163
CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NC3=CC=CC(=C3)C4=NC=NN4
CSc1cccc(c1)N1CC(CC1=O)C(=O)Nc1cccc(c1)c1n(nH)cn1
CSc1cccc(c1)N1CC(CC1=O)C(=O)Nc1cccc(c1)c1nnc(nH)1
InChI=1SC20H19N5O2Sc1281773616(1017)251114(918(25)26)20(27)231552413(815)192112222419h28101214H911H21H3(H2327)(H212224)
MFCD30708597
N(3(1H124triazol3yl)phenyl)1(3(methylthio)phenyl)5oxopyrrolidine3carboxamide
ZINC000218203667
ZINC000218203760
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