6-(nitrosomethylidene)-2-(phenylmethylsulfanyl)-1H-pyrimidine

Systemtic Name: 6-(nitrosomethylidene)-2-(phenylmethylsulfanyl)-1H-pyrimidine Openeye Name: 2-benzylsulfanyl-6-(nitrosomethylene)-1H-pyrimidine CAS Name: 6-(nitrosomethylidene)-2-(phenylmethylthio)-1H-pyrimidine IUPAC Name: 2-benzylsulfanyl-6-(nitrosomethylidene)-1H-pyrimidine Traditional Name: 2-(benzylthio)-6-(nitrosomethylene)-1H-pyrimidine Formula: C12H11N3OS MolecularWeight: 245.30024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3OS/c16-14-8-11-6-7-13-12(15-11)17-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,13,15)