5-chloranyl-2-(naphthalen-1-ylmethylsulfanyl)pyrimidine-4-carboxylate

Systemtic Name: 5-chloranyl-2-(naphthalen-1-ylmethylsulfanyl)pyrimidine-4-carboxylate Openeye Name: 5-chloro-2-(1-naphthylmethylsulfanyl)pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(1-naphthalenylmethylthio)-4-pyrimidinecarboxylate IUPAC Name: 5-chloro-2-(naphthalen-1-ylmethylsulfanyl)pyrimidine-4-carboxylate Traditional Name: 5-chloro-2-(1-naphthylmethylthio)pyrimidine-4-carboxylate Formula: C16H10ClN2O2S- MolecularWeight: 329.7808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSC3=NC=C(C(=N3)C(=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSC3=NC=C(C(=N3)C(=O)[O-])Cl

InChI

InChI=1S/C16H11ClN2O2S/c17-13-8-18-16(19-14(13)15(20)21)22-9-11-6-3-5-10-4-1-2-7-12(10)11/h1-8H,9H2,(H,20,21)/p-1