4-chloranyl-2-methylsulfanyl-6-(pentan-3-ylamino)pyrimidine-5-carbaldehyde

Systemtic Name: 4-chloranyl-2-methylsulfanyl-6-(pentan-3-ylamino)pyrimidine-5-carbaldehyde Openeye Name: 4-chloro-6-(1-ethylpropylamino)-2-methylsulfanyl-pyrimidine-5-carbaldehyde CAS Name: 4-chloro-2-(methylthio)-6-(pentan-3-ylamino)-5-pyrimidinecarboxaldehyde IUPAC Name: 4-chloro-2-methylsulfanyl-6-(pentan-3-ylamino)pyrimidine-5-carbaldehyde Traditional Name: 4-chloro-6-(1-ethylpropylamino)-2-(methylthio)pyrimidine-5-carbaldehyde Formula: C11H16ClN3OS MolecularWeight: 273.78224

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C(=NC(=N1)SC)Cl)C=O

Isomeric SMILES

CCC(CC)NC1=C(C(=NC(=N1)SC)Cl)C=O

InChI

InChI=1S/C11H16ClN3OS/c1-4-7(5-2)13-10-8(6-16)9(12)14-11(15-10)17-3/h6-7H,4-5H2,1-3H3,(H,13,14,15)