2-(phenylmethylsulfanyl)-4-pyridin-3-yl-pyrimidine

Systemtic Name: 2-(phenylmethylsulfanyl)-4-pyridin-3-yl-pyrimidine Openeye Name: 2-benzylsulfanyl-4-(3-pyridyl)pyrimidine CAS Name: 2-(phenylmethylthio)-4-(3-pyridinyl)pyrimidine IUPAC Name: 2-benzylsulfanyl-4-pyridin-3-ylpyrimidine Traditional Name: 2-(benzylthio)-4-(3-pyridyl)pyrimidine Formula: C16H13N3S MolecularWeight: 279.35952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=CC(=N2)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=CC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C16H13N3S/c1-2-5-13(6-3-1)12-20-16-18-10-8-15(19-16)14-7-4-9-17-11-14/h1-11H,12H2