2-[(4-Cyano-5,6,7,8-tetrahydro-1-methyl-3-isoquinolyl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide

SpectraBase Compound ID	Fh1L4Cnb7mG
InChI	InChI=1S/C20H18F3N3OS/c1-12-15-7-2-3-8-16(15)17(10-24)19(25-12)28-11-18(27)26-14-6-4-5-13(9-14)20(21,22)23/h4-6,9H,2-3,7-8,11H2,1H3,(H,26,27)
InChIKey	UNGUQPXWIZYGSW-UHFFFAOYSA-N Google Search
Mol Weight	405.44 g/mol
Molecular Formula	C20H18F3N3OS
Exact Mass	405.112268 g/mol

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SpectraBase Spectrum ID	KG7axYDy0yE
Name	2-[(4-CYANO-5,6,7,8-TETRAHYDRO-1-METHYL-3-ISOQUINOLYL)THIO]-N-[3-
Copyright	Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula	C20H18F3N3OS
InChI	InChI=1S/C20H18F3N3OS/c1-12-15-7-2-3-8-16(15)17(10-24)19(25-12)28-11-18(27)26-14-6-4-5-13(9-14)20(21,22)23/h4-6,9H,2-3,7-8,11H2,1H3,(H,26,27)
InChIKey	UNGUQPXWIZYGSW-UHFFFAOYSA-N
Molecular Weight	405.1119
SMILES	N(c1cccc(C(F)(F)F)c1)C(=O)CSc1nc(C)c2CCCCc2c1C#N
SPLASH	splash10-014i-5690000000-abf3de184db3c1811a64
Source of Spectrum	Chemical Concepts, A Wiley Division, Weinheim, Germany