For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-[(7aR)-3-(4-methoxyphenyl)-7-oxo-5-sulfanylidene-3,7a-dihydro-1H-imidazo[1,5-c]thiazol-6-yl]benzoic acid ethyl ester
SpectraBase Compound ID DFcFR5XnMMF
InChI InChI=1S/C21H20N2O4S2/c1-3-27-20(25)14-4-8-15(9-5-14)22-18(24)17-12-29-19(23(17)21(22)28)13-6-10-16(26-2)11-7-13/h4-11,17,19H,3,12H2,1-2H3/t17-,19?/m0/s1
InChIKey QHBPMBHZCNXXJP-KKFHFHRHSA-N
Mol Weight 428.52 g/mol
Molecular Formula C21H20N2O4S2
Exact Mass 428.086449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CACSr1dBCs0
Name 4-[(7aR)-3-(4-methoxyphenyl)-7-oxo-5-sulfanylidene-3,7a-dihydro-1H-imidazo[1,5-c]thiazol-6-yl]benzoic acid ethyl ester
Alternate Name(s) 4-[(7aR)-7-keto-3-(4-methoxyphenyl)-5-thioxo-3,7a-dihydro-1H-imidazo[1,5-c]thiazol-6-yl]benzoic acid ethyl ester Ethyl 4-[(7aR)-3-(4-methoxyphenyl)-7-oxidanylidene-5-sulfanylidene-3,7a-dihydro-1H-imidazo[1,5-c][1,3]thiazol-6-yl]benzoate Ethyl 4-[(7aR)-3-(4-methoxyphenyl)-7-oxo-5-sulfanylidene-3,7a-dihydro-1H-imidazo[1,5-c][1,3]thiazol-6-yl]benzoate Ethyl 4-[(7aR)-3-(4-methoxyphenyl)-7-oxo-5-thioxo-3,7a-dihydro-1H-imidazo[1,5-c]thiazol-6-yl]benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2O4S2
InChI InChI=1S/C21H20N2O4S2/c1-3-27-20(25)14-4-8-15(9-5-14)22-18(24)17-12-29-19(23(17)21(22)28)13-6-10-16(26-2)11-7-13/h4-11,17,19H,3,12H2,1-2H3/t17-,19?/m0/s1
InChIKey QHBPMBHZCNXXJP-KKFHFHRHSA-N
Molecular Weight 428.521 g/mol
SMILES CCOC(c1ccc(N2C(N3[C@](C2=O)(CSC3c2ccc(cc2)OC)[H])=S)cc1)=O
SPLASH splash10-0fb9-1912400000-06f24bd5a5d84b67afd7
Wiley ID 1443236