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S-Benzyl-N-(3,5-dinitrobenzoyl)cysteine N'-[1-(4-chlorophenyl)ethylidene]hydrazide
SpectraBase Compound ID 9hVI2Kp1wW8
InChI InChI=1S/C25H22ClN5O6S/c1-16(18-7-9-20(26)10-8-18)28-29-25(33)23(15-38-14-17-5-3-2-4-6-17)27-24(32)19-11-21(30(34)35)13-22(12-19)31(36)37/h2-13,23H,14-15H2,1H3,(H,27,32)(H,29,33)/b28-16+
InChIKey FRTWIORIMRPCII-LQKURTRISA-N
Mol Weight 555.99 g/mol
Molecular Formula C25H22ClN5O6S
Exact Mass 555.097932 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Bgp7rL2afO
Name S-Benzyl-N-(3,5-dinitrobenzoyl)cysteine N'-[1-(4-chlorophenyl)ethylidene]hydrazide
Alternate Name(s) N-[1-[(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-3,5-dinitro-benzamide N-[1-[(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-1-oxo-3-(phenylmethylthio)propan-2-yl]-3,5-dinitrobenzamide N-[1-[(benzylthio)methyl]-2-[(N'E)-N'-[1-(4-chlorophenyl)ethylidene]hydrazino]-2-keto-ethyl]-3,5-dinitro-benzamide N-[3-benzylsulfanyl-1-[(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl]-1-oxopropan-2-yl]-3,5-dinitrobenzamide
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Formula C25H22ClN5O6S
InChI InChI=1S/C25H22ClN5O6S/c1-16(18-7-9-20(26)10-8-18)28-29-25(33)23(15-38-14-17-5-3-2-4-6-17)27-24(32)19-11-21(30(34)35)13-22(12-19)31(36)37/h2-13,23H,14-15H2,1H3,(H,27,32)(H,29,33)/b28-16+
InChIKey FRTWIORIMRPCII-LQKURTRISA-N
Molecular Weight 555.993 g/mol
SMILES N(C(c1cc(cc(c1)N(=O)=O)N(=O)=O)=O)C(C(=O)N\N=C/(C)c1ccc(cc1)Cl)CSCc1ccccc1
SPLASH splash10-0006-9700000000-eca9d285e6049349089f
Wiley ID 1467398