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5'-(4-Chlorophenyl)-3',4'-dihydro-4'-oxo-1'H-spiro[cyclopentane-1,2'-thieno[2,3-d]pyrimidine]-6'-carboxamide
SpectraBase Compound ID Lq0gOl4RaCy
InChI InChI=1S/C17H16ClN3O2S/c18-10-5-3-9(4-6-10)11-12-15(23)20-17(7-1-2-8-17)21-16(12)24-13(11)14(19)22/h3-6,21H,1-2,7-8H2,(H2,19,22)(H,20,23)
InChIKey AGCZAPXWRBUVOV-UHFFFAOYSA-N
Mol Weight 361.85 g/mol
Molecular Formula C17H16ClN3O2S
Exact Mass 361.065176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DK8Pxw4beTC
Name 5'-(4-Chlorophenyl)-3',4'-dihydro-4'-oxo-1'H-spiro[cyclopentane-1,2'-thieno[2,3-d]pyrimidine]-6'-carboxamide
Alternate Name(s) 5-(4-chlorophenyl)-4-oxo-6-spiro[1,3-dihydrothieno[2,3-d]pyrimidine-2,1'-cyclopentane]carboxamide 5-(4-chlorophenyl)-4-oxospiro[1,3-dihydrothieno[2,3-d]pyrimidine-2,1'-cyclopentane]-6-carboxamide 5-(4-chlorophenyl)-4-oxo-spiro[1,3-dihydrothieno[2,3-d]pyrimidine-2,1'-cyclopentane]-6-carboxamide 5-(4-chlorophenyl)-4-oxidanylidene-spiro[1,3-dihydrothieno[2,3-d]pyrimidine-2,1'-cyclopentane]-6-carboxamide
Comments Less than 3 mono-isotopic peaks
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Formula C17H16ClN3O2S
InChI InChI=1S/C17H16ClN3O2S/c18-10-5-3-9(4-6-10)11-12-15(23)20-17(7-1-2-8-17)21-16(12)24-13(11)14(19)22/h3-6,21H,1-2,7-8H2,(H2,19,22)(H,20,23)
InChIKey AGCZAPXWRBUVOV-UHFFFAOYSA-N
Molecular Weight 361.847 g/mol
SMILES NC(c1sc2c(C(NC3(CCCC3)N2)=O)c1-c1ccc(cc1)Cl)=O
SPLASH splash10-03di-0009000000-2bffb8787b4d17e3194c
Source of Spectrum Y-49-368-10a
Wiley ID 1706560