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7-Phenyl-4-(1-pyrrolidinyl)-6,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-7-carbonitrile
SpectraBase Compound ID CNUVMESrPmw
InChI InChI=1S/C21H20N4S/c22-13-21(15-6-2-1-3-7-15)9-8-16-17(12-21)26-20-18(16)19(23-14-24-20)25-10-4-5-11-25/h1-3,6-7,14H,4-5,8-12H2
InChIKey ZURIBAMFMJIGCE-UHFFFAOYSA-N
Mol Weight 360.48 g/mol
Molecular Formula C21H20N4S
Exact Mass 360.140868 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7SlsZE5M2JZ
Name 7-Phenyl-4-(1-pyrrolidinyl)-6,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-7-carbonitrile
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N4S
InChI InChI=1S/C21H20N4S/c22-13-21(15-6-2-1-3-7-15)9-8-16-17(12-21)26-20-18(16)19(23-14-24-20)25-10-4-5-11-25/h1-3,6-7,14H,4-5,8-12H2
InChIKey ZURIBAMFMJIGCE-UHFFFAOYSA-N
Molecular Weight 360.479 g/mol
SMILES c12c(sc3c2CCC(C#N)(c2ccccc2)C3)ncnc1N1CCCC1
SPLASH splash10-0wa0-4963000000-6a7e22a6a7be28483ae1
Synonyms 7-Phenyl-4-pyrrolidin-1-yl-6,8-dihydro-5H-benzothiopheno[2,3-d]pyrimidine-7-carbonitrile 7-Phenyl-4-pyrrolidin-1-yl-6,8-dihydro-5H-[1]benzothiolo[2,3-d]pyrimidine-7-carbonitrile 7-Phenyl-4-pyrrolidino-6,8-dihydro-5H-benzothiopheno[2,3-d]pyrimidine-7-carbonitrile
Wiley ID 1453237