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Isopropyl 4-(4-chlorophenyl)-5-methyl-2-[(2-pyrazinylcarbonyl)amino]-3-thiophenecarboxylate

View entire compound with spectra: 2 NMR

Isopropyl 4-(4-chlorophenyl)-5-methyl-2-[(2-pyrazinylcarbonyl)amino]-3-thiophenecarboxylate
SpectraBase Compound ID 8Xn4Y06qUKQ
InChI InChI=1S/C20H18ClN3O3S/c1-11(2)27-20(26)17-16(13-4-6-14(21)7-5-13)12(3)28-19(17)24-18(25)15-10-22-8-9-23-15/h4-11H,1-3H3,(H,24,25)
InChIKey CLPNPURXHILJJL-UHFFFAOYSA-N
Mol Weight 415.9 g/mol
Molecular Formula C20H18ClN3O3S
Exact Mass 415.07574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B6dBLH28LPw
Name Isopropyl 4-(4-chlorophenyl)-5-methyl-2-[(2-pyrazinylcarbonyl)amino]-3-thiophenecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.075740323 u
Formula C20H18ClN3O3S
InChI InChI=1S/C20H18ClN3O3S/c1-11(2)27-20(26)17-16(13-4-6-14(21)7-5-13)12(3)28-19(17)24-18(25)15-10-22-8-9-23-15/h4-11H,1-3H3,(H,24,25)
InChIKey CLPNPURXHILJJL-UHFFFAOYSA-N
Molecular Weight 415.895 g/mol
SMILES N(C1=C(C(=C(C)S1)C=1C=CC(=CC1)Cl)C(OC(C)C)=O)C(C1=NC=CN=C1)=O