4-chloranyl-2-(phenylmethylsulfanyl)-6-pyrrolidin-1-yl-pyrimidine

Systemtic Name: 4-chloranyl-2-(phenylmethylsulfanyl)-6-pyrrolidin-1-yl-pyrimidine Openeye Name: 2-benzylsulfanyl-4-chloro-6-pyrrolidin-1-yl-pyrimidine CAS Name: 4-chloro-2-(phenylmethylthio)-6-(1-pyrrolidinyl)pyrimidine IUPAC Name: 2-benzylsulfanyl-4-chloro-6-pyrrolidin-1-ylpyrimidine Traditional Name: 2-(benzylthio)-4-chloro-6-pyrrolidino-pyrimidine Formula: C15H16ClN3S MolecularWeight: 305.82564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC(=N2)SCC3=CC=CC=C3)Cl

Isomeric SMILES

C1CCN(C1)C2=CC(=NC(=N2)SCC3=CC=CC=C3)Cl

InChI

InChI=1S/C15H16ClN3S/c16-13-10-14(19-8-4-5-9-19)18-15(17-13)20-11-12-6-2-1-3-7-12/h1-3,6-7,10H,4-5,8-9,11H2