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(E)-Methyl 2-(1H-indol-3-yl)-3-(3-phenylthioureido)propenoate
SpectraBase Compound ID DuXHWBJyj0H
InChI InChI=1S/C19H17N3O2S/c1-24-18(23)16(15-11-20-17-10-6-5-9-14(15)17)12-21-19(25)22-13-7-3-2-4-8-13/h2-12,20H,1H3,(H2,21,22,25)/b16-12+
InChIKey PNVQXCMAOIWTMI-FOWTUZBSSA-N
Mol Weight 351.42 g/mol
Molecular Formula C19H17N3O2S
Exact Mass 351.104148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A9MSpSitVSc
Name (E)-Methyl 2-(1H-indol-3-yl)-3-(3-phenylthioureido)propenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17N3O2S
InChI InChI=1S/C19H17N3O2S/c1-24-18(23)16(15-11-20-17-10-6-5-9-14(15)17)12-21-19(25)22-13-7-3-2-4-8-13/h2-12,20H,1H3,(H2,21,22,25)/b16-12+
InChIKey PNVQXCMAOIWTMI-FOWTUZBSSA-N
Molecular Weight 351.424 g/mol
SMILES [nH]1c2c(c(\C(=C/NC(Nc3ccccc3)=S)C(=O)OC)c1)cccc2
SPLASH splash10-0k96-0975000000-b1227e483d174988984e
Source of Spectrum KC-61-7516-8
Synonyms Methyl (2E)-3-[(anilinocarbothioyl)amino]-2-(1H-indol-3-yl)-2-propenoate
Wiley ID 1629962