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Methyl 2-Methyl-7-methoxy-4-[3'-phenylthioindol-2-yl]quinazoline-6-carboxylate
SpectraBase Compound ID 9tesX3MPADM
InChI InChI=1S/C26H21N3O3S/c1-15-27-21-14-22(31-2)19(26(30)32-3)13-18(21)23(28-15)24-25(33-16-9-5-4-6-10-16)17-11-7-8-12-20(17)29-24/h4-14,29H,1-3H3
InChIKey XMBZOIDIIUKIJM-UHFFFAOYSA-N
Mol Weight 455.53 g/mol
Molecular Formula C26H21N3O3S
Exact Mass 455.130363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EK77skupxL8
Name Methyl 2-Methyl-7-methoxy-4-[3'-phenylthioindol-2-yl]quinazoline-6-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H21N3O3S
InChI InChI=1S/C26H21N3O3S/c1-15-27-21-14-22(31-2)19(26(30)32-3)13-18(21)23(28-15)24-25(33-16-9-5-4-6-10-16)17-11-7-8-12-20(17)29-24/h4-14,29H,1-3H3
InChIKey XMBZOIDIIUKIJM-UHFFFAOYSA-N
Molecular Weight 455.532 g/mol
SMILES [nH]1c2ccccc2c(c1-c1c2c(nc(n1)C)cc(OC)c(c2)C(=O)OC)Sc1ccccc1
SPLASH splash10-0ab9-9300500000-315334667cf6d7ff5888
Source of Spectrum O1-60-1192-2
Synonyms Methyl 7-methoxy-2-methyl-4-[3-(phenylsulfanyl)-1H-indol-2-yl]-6-quinazolinecarboxylate
Wiley ID 1592111