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N,N-Diethyl-2(S)-[2,3-dihydro-3-phenyl-10bH-1,3,4-thiadiazolo[2,3-a]isoquinolin-2-ylidene]propanethiomide
SpectraBase Compound ID 9p7Xf8HYQ80
InChI InChI=1S/C23H25N3S2/c1-4-24(5-2)21(27)17(3)22-26(19-12-7-6-8-13-19)25-16-15-18-11-9-10-14-20(18)23(25)28-22/h6-16,23H,4-5H2,1-3H3/b22-17-/t23-/m0/s1
InChIKey HHEPKMCJOPHGDM-RJYQMNAMSA-N
Mol Weight 407.59 g/mol
Molecular Formula C23H25N3S2
Exact Mass 407.14899 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOv6P7X2wtZ
Name N,N-Diethyl-2(S)-[2,3-dihydro-3-phenyl-10bH-1,3,4-thiadiazolo[2,3-a]isoquinolin-2-ylidene]propanethiomide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H25N3S2
InChI InChI=1S/C23H25N3S2/c1-4-24(5-2)21(27)17(3)22-26(19-12-7-6-8-13-19)25-16-15-18-11-9-10-14-20(18)23(25)28-22/h6-16,23H,4-5H2,1-3H3/b22-17-/t23-/m0/s1
InChIKey HHEPKMCJOPHGDM-RJYQMNAMSA-N
Molecular Weight 407.594 g/mol
SMILES C=1N2N(\C(S[C@]2(c2c(C1)cccc2)[H])=C\(C(=S)N(CC)CC)C)c1ccccc1
SPLASH splash10-004i-0900000000-30306520c467fc7bb004
Source of Spectrum F-54-9856-5
Synonyms (2Z)-2-((10bS)-3-phenyl-10bH-[1,3,4]thiadiazolo[2,3-a]isoquinolin-2(3H)-ylidene)-N,N-diethylpropanethioamide N,N-Diethyl-2-[2,3-dihydro-3-phenyl-10bH-1,3,4-thiadiazolo[2,3-a]isoquinolin-2-ylidene]propanethiomide
Wiley ID 808396