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Benzenamine, N-[4-[(4-chlorophenyl)thio]-2-butynyl]-4-methyl-N-[2-(phenylthio)-2-propenyl]-
SpectraBase Compound ID 9LrYQdcmRfq
InChI InChI=1S/C26H24ClNS2/c1-21-10-14-24(15-11-21)28(20-22(2)30-26-8-4-3-5-9-26)18-6-7-19-29-25-16-12-23(27)13-17-25/h3-5,8-17H,2,18-20H2,1H3
InChIKey ZVGZMUFPDZXINC-UHFFFAOYSA-N
Mol Weight 450.06 g/mol
Molecular Formula C26H24ClNS2
Exact Mass 449.10387 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 85E49IVoGqe
Name Benzenamine, N-[4-[(4-chlorophenyl)thio]-2-butynyl]-4-methyl-N-[2-(phenylthio)-2-propenyl]-
CAS Registry Number 97840-80-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H24ClNS2
InChI InChI=1S/C26H24ClNS2/c1-21-10-14-24(15-11-21)28(20-22(2)30-26-8-4-3-5-9-26)18-6-7-19-29-25-16-12-23(27)13-17-25/h3-5,8-17H,2,18-20H2,1H3
InChIKey ZVGZMUFPDZXINC-UHFFFAOYSA-N
Molecular Weight 450.058 g/mol
SMILES C(CN(c1ccc(cc1)C)CC#CCSc1ccc(cc1)Cl)(Sc1ccccc1)=C
SPLASH splash10-052b-0905300000-14e3d386dd3b94008f75
Source of Spectrum O-20-229-3
Synonyms N-(4'-(4-chlorophenyl)thio-2'-butynyl)-N-(2''-phenylthio-2''-propenyl)-para-toluidine N-(4'-(4-chlorophenyl)thio-2'-butynyl)-N-(2''-phenylthio-2''-propenyl)-para-toluidine N-{4-[(4-chlorophenyl)sulfanyl]-2-butynyl}-4-methyl-N-[2-(phenylsulfanyl)-2-propenyl]aniline N-{4-[(4-chlorophenyl)sulfanyl]-2-butynyl}-N-(4-methylphenyl)-N-[2-(phenylsulfanyl)-2-propenyl]amine
Wiley ID 1387463