2-Methyl-7-phenyl-4-phenylthio-5,5a,8a,9-tetrahydropyrrolo[3,4-g]quinazolin-6,8-dione

SpectraBase Compound ID	1DmpcqV1mTm
InChI	InChI=1S/C23H19N3O2S/c1-14-24-20-13-18-17(22(27)26(23(18)28)15-8-4-2-5-9-15)12-19(20)21(25-14)29-16-10-6-3-7-11-16/h2-11,17-18H,12-13H2,1H3/t17-,18+/m1/s1
InChIKey	MQPAWAVHLRTPPH-MSOLQXFVSA-N Google Search
Mol Weight	401.48 g/mol
Molecular Formula	C23H19N3O2S
Exact Mass	401.119798 g/mol

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SpectraBase Spectrum ID	4bfogNpmRU
Name	2-Methyl-7-phenyl-4-phenylthio-5,5a,8a,9-tetrahydropyrrolo[3,4-g]quinazolin-6,8-dione
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C23H19N3O2S
InChI	InChI=1S/C23H19N3O2S/c1-14-24-20-13-18-17(22(27)26(23(18)28)15-8-4-2-5-9-15)12-19(20)21(25-14)29-16-10-6-3-7-11-16/h2-11,17-18H,12-13H2,1H3/t17-,18+/m1/s1
InChIKey	MQPAWAVHLRTPPH-MSOLQXFVSA-N
Molecular Weight	401.484 g/mol
SMILES	C1(N(C([C@]2(Cc3nc(nc(c3C[C@@]12[H])Sc1ccccc1)C)[H])=O)c1ccccc1)=O
SPLASH	splash10-0ufr-8690600000-93fabe812599c76baa91
Source of Spectrum	F-52-1744-17
Synonyms	(5aR,8aS)-2-Methyl-7-phenyl-4-phenylsulfanyl-5,5a,8a,9-tetrahydro-pyrrolo[3,4-g]quinazoline-6,8-dione 2-Methyl-7-phenyl-4-(phenylsulfanyl)-8a,9-dihydro-5H-pyrrolo[3,4-g]quinazoline-6,8(5aH,7H)-dione
Wiley ID	794930