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Ethyl (2Z)-2-(5-amino-1,3,4-thiadiazol-2-yl)-3-(4-bromophenyl)-2-propenoate
SpectraBase Compound ID EFd5mOabqGv
InChI InChI=1S/C13H12BrN3O2S/c1-2-19-12(18)10(11-16-17-13(15)20-11)7-8-3-5-9(14)6-4-8/h3-7H,2H2,1H3,(H2,15,17)/b10-7+
InChIKey BUIKOQOSTHVHKA-JXMROGBWSA-N
Mol Weight 354.22 g/mol
Molecular Formula C13H12BrN3O2S
Exact Mass 352.983361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 109ccaAVZYL
Name Ethyl (2Z)-2-(5-amino-1,3,4-thiadiazol-2-yl)-3-(4-bromophenyl)-2-propenoate
Alternate Name(s) (Z)-2-(5-amino-1,3,4-thiadiazol-2-yl)-3-(4-bromophenyl)-2-propenoic acid ethyl ester (Z)-2-(5-amino-1,3,4-thiadiazol-2-yl)-3-(4-bromophenyl)acrylic acid ethyl ester 1,3,4-Thiadiazole-2-acetic acid, 5-amino-.alpha.-[(4-bromophenyl)methylene]-, ethyl ester Ethyl (Z)-2-(5-amino-1,3,4-thiadiazol-2-yl)-3-(4-bromophenyl)prop-2-enoate Ethyl (Z)-2-(5-azanyl-1,3,4-thiadiazol-2-yl)-3-(4-bromophenyl)prop-2-enoate
CAS Registry Number 298684-63-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12BrN3O2S
InChI InChI=1S/C13H12BrN3O2S/c1-2-19-12(18)10(11-16-17-13(15)20-11)7-8-3-5-9(14)6-4-8/h3-7H,2H2,1H3,(H2,15,17)/b10-7+
InChIKey BUIKOQOSTHVHKA-JXMROGBWSA-N
Molecular Weight 354.222 g/mol
SMILES Nc1sc(\C(C(=O)OCC)=C/c2ccc(cc2)Br)nn1
SPLASH splash10-0udi-6529000000-fa8030ad0a2b9dcbfc28
Source of Spectrum AD-0-2532-0
Wiley ID 1431167