4-azanyl-2-(phenylmethylsulfanyl)pyrimidine-5-carbaldehyde

Systemtic Name: 4-azanyl-2-(phenylmethylsulfanyl)pyrimidine-5-carbaldehyde Openeye Name: 4-amino-2-benzylsulfanyl-pyrimidine-5-carbaldehyde CAS Name: 4-amino-2-(phenylmethylthio)-5-pyrimidinecarboxaldehyde IUPAC Name: 4-amino-2-benzylsulfanylpyrimidine-5-carbaldehyde Traditional Name: 4-amino-2-(benzylthio)pyrimidine-5-carbaldehyde Formula: C12H11N3OS MolecularWeight: 245.30024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=C(C(=N2)N)C=O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=C(C(=N2)N)C=O

InChI

InChI=1S/C12H11N3OS/c13-11-10(7-16)6-14-12(15-11)17-8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,13,14,15)