4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylsulfanyl-pyrimidine-5-carbaldehyde

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylsulfanyl-pyrimidine-5-carbaldehyde Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylsulfanyl-pyrimidine-5-carbaldehyde CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(methylthio)-5-pyrimidinecarboxaldehyde IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylsulfanylpyrimidine-5-carbaldehyde Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(methylthio)pyrimidine-5-carbaldehyde Formula: C15H15N3OS MolecularWeight: 285.3641

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)N2CCC3=CC=CC=C3C2)C=O

Isomeric SMILES

CSC1=NC=C(C(=N1)N2CCC3=CC=CC=C3C2)C=O

InChI

InChI=1S/C15H15N3OS/c1-20-15-16-8-13(10-19)14(17-15)18-7-6-11-4-2-3-5-12(11)9-18/h2-5,8,10H,6-7,9H2,1H3