3-[5'-(Benzofuran-2'-yl)-1'-phenyl-1H-pyrazol-3'-yl]-6-phenyl- 7H-(1,2,4)-triazolo[3,4-b]-(1,3,4)-thiadiazine

SpectraBase Compound ID	BzNUKifnjNO
InChI	InChI=1S/C27H18N6OS/c1-3-9-18(10-4-1)22-17-35-27-29-28-26(33(27)31-22)21-16-23(32(30-21)20-12-5-2-6-13-20)25-15-19-11-7-8-14-24(19)34-25/h1-16H,17H2
InChIKey	AHRIAVCEVNGLSL-UHFFFAOYSA-N Google Search
Mol Weight	474.54 g/mol
Molecular Formula	C27H18N6OS
Exact Mass	474.12628 g/mol

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SpectraBase Spectrum ID	BhcZpyje1Oe
Name	3-[5'-(Benzofuran-2'-yl)-1'-phenyl-1H-pyrazol-3'-yl]-6-phenyl- 7H-(1,2,4)-triazolo[3,4-b]-(1,3,4)-thiadiazine
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H18N6OS
InChI	InChI=1S/C27H18N6OS/c1-3-9-18(10-4-1)22-17-35-27-29-28-26(33(27)31-22)21-16-23(32(30-21)20-12-5-2-6-13-20)25-15-19-11-7-8-14-24(19)34-25/h1-16H,17H2
InChIKey	AHRIAVCEVNGLSL-UHFFFAOYSA-N
Molecular Weight	474.542 g/mol
SMILES	c1([n]2c(nn1)SCC(=N2)c1ccccc1)-c1n[n](-c2ccccc2)c(c1)-c1oc2ccccc2c1
SPLASH	splash10-004i-9000100000-6056a44b7a617b3dce5a
Source of Spectrum	AH-140-604-11
Synonyms	3-[5-(2-benzofuranyl)-1-phenyl-3-pyrazolyl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine 3-[5-(1-benzofuran-2-yl)-1-phenylpyrazol-3-yl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine 3-[5-(1-benzofuran-2-yl)-1-phenyl-pyrazol-3-yl]-6-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Wiley ID	1696164