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1-BENZYLIDENEAMINO-5-(1,2-DIISOPROPYLCARBONYL)-HYDRAZINO-2-METHYLTHIO-4-PHENYL-1-IMIDAZOLE
SpectraBase Compound ID 7sIAgElas9A
InChI InChI=1S/C25H29N5O4S/c1-17(2)33-24(31)28-30(25(32)34-18(3)4)22-21(20-14-10-7-11-15-20)27-23(35-5)29(22)26-16-19-12-8-6-9-13-19/h6-18H,1-5H3,(H,28,31)/b26-16+
InChIKey YLXRQYKSLZJPHQ-WGOQTCKBSA-N
Mol Weight 495.6 g/mol
Molecular Formula C25H29N5O4S
Exact Mass 495.194026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1QPvJWkRqC
Name isopropyl N-[3-[(E)-benzylideneamino]-2-methylsulfanyl-5-phenyl-imidazol-4-yl]-N-(isopropoxycarbonylamino)carbamate
Alternate Name(s) N-[2-(methylthio)-5-phenyl-3-[(E)-(phenylmethylene)amino]-4-imidazolyl]-N-[[oxo(propan-2-yloxy)methyl]amino]carbamic acid propan-2-yl ester N-[3-[(E)-benzalamino]-2-(methylthio)-5-phenyl-imidazol-4-yl]-N-(isopropoxycarbonylamino)carbamic acid isopropyl ester Propan-2-yl N-[2-methylsulfanyl-5-phenyl-3-[(E)-(phenylmethylidene)amino]imidazol-4-yl]-N-(propan-2-yloxycarbonylamino)carbamate Propan-2-yl N-[3-[(E)-benzylideneamino]-2-methylsulfanyl-5-phenylimidazol-4-yl]-N-(propan-2-yloxycarbonylamino)carbamate
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Formula C25H29N5O4S
InChI InChI=1S/C25H29N5O4S/c1-17(2)33-24(31)28-30(25(32)34-18(3)4)22-21(20-14-10-7-11-15-20)27-23(35-5)29(22)26-16-19-12-8-6-9-13-19/h6-18H,1-5H3,(H,28,31)/b26-16+
InChIKey YLXRQYKSLZJPHQ-WGOQTCKBSA-N
Molecular Weight 495.598 g/mol
SMILES N(N(c1[n](c(SC)nc1-c1ccccc1)\N=C\c1ccccc1)C(OC(C)C)=O)C(=O)OC(C)C
SPLASH splash10-0ktb-0321900000-60aa75067e8fedc94b9f
Source of Spectrum Y-33-44-20
Wiley ID 1398062