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4-(N-Cyclopropylmethyl-N-methylamino)-8-[(5-fluoro-6-methoxy-2-benzimidazolyl)thiiomethyl]-1-ethyl-1,2,3,4-tetrahydroquinoline
SpectraBase Compound ID Lv2tmnlmg0v
InChI InChI=1S/C25H31FN4OS/c1-4-30-11-10-22(29(2)14-16-8-9-16)18-7-5-6-17(24(18)30)15-32-25-27-20-12-19(26)23(31-3)13-21(20)28-25/h5-7,12-13,16,22H,4,8-11,14-15H2,1-3H3,(H,27,28)
InChIKey WWEXXFQEJRMVLY-UHFFFAOYSA-N
Mol Weight 454.61 g/mol
Molecular Formula C25H31FN4OS
Exact Mass 454.220261 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7lR0nUfR4ng
Name 4-(N-Cyclopropylmethyl-N-methylamino)-8-[(5-fluoro-6-methoxy-2-benzimidazolyl)thiiomethyl]-1-ethyl-1,2,3,4-tetrahydroquinoline
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H31FN4OS
InChI InChI=1S/C25H31FN4OS/c1-4-30-11-10-22(29(2)14-16-8-9-16)18-7-5-6-17(24(18)30)15-32-25-27-20-12-19(26)23(31-3)13-21(20)28-25/h5-7,12-13,16,22H,4,8-11,14-15H2,1-3H3,(H,27,28)
InChIKey WWEXXFQEJRMVLY-UHFFFAOYSA-N
Molecular Weight 454.608 g/mol
SMILES [nH]1c2cc(c(cc2nc1SCc1c2c(C(N(CC3CC3)C)CCN2CC)ccc1)F)OC
SPLASH splash10-05g0-2921100000-1f07eb34388912de77c8
Source of Spectrum E1-38-1585-16
Wiley ID 1518391