5-chloranyl-N-naphthalen-1-yl-2-(phenylmethylsulfanyl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-naphthalen-1-yl-2-(phenylmethylsulfanyl)pyrimidine-4-carboxamide Openeye Name: 2-benzylsulfanyl-5-chloro-N-(1-naphthyl)pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(1-naphthalenyl)-2-(phenylmethylthio)-4-pyrimidinecarboxamide IUPAC Name: 2-benzylsulfanyl-5-chloro-N-naphthalen-1-ylpyrimidine-4-carboxamide Traditional Name: 2-(benzylthio)-5-chloro-N-(1-naphthyl)pyrimidine-4-carboxamide Formula: C22H16ClN3OS MolecularWeight: 405.89994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NC3=CC=CC4=CC=CC=C43)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NC3=CC=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C22H16ClN3OS/c23-18-13-24-22(28-14-15-7-2-1-3-8-15)26-20(18)21(27)25-19-12-6-10-16-9-4-5-11-17(16)19/h1-13H,14H2,(H,25,27)