4-(phenylsulfanylmethyl)-2-pyridin-4-yl-6-pyrrolidin-1-yl-pyrimidine

Systemtic Name: 4-(phenylsulfanylmethyl)-2-pyridin-4-yl-6-pyrrolidin-1-yl-pyrimidine Openeye Name: 4-(phenylsulfanylmethyl)-2-(4-pyridyl)-6-pyrrolidin-1-yl-pyrimidine CAS Name: 4-[(phenylthio)methyl]-2-pyridin-4-yl-6-(1-pyrrolidinyl)pyrimidine IUPAC Name: 4-(phenylsulfanylmethyl)-2-pyridin-4-yl-6-pyrrolidin-1-ylpyrimidine Traditional Name: 4-[(phenylthio)methyl]-2-(4-pyridyl)-6-pyrrolidino-pyrimidine Formula: C20H20N4S MolecularWeight: 348.4646

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC(=C2)CSC3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

C1CCN(C1)C2=NC(=NC(=C2)CSC3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C20H20N4S/c1-2-6-18(7-3-1)25-15-17-14-19(24-12-4-5-13-24)23-20(22-17)16-8-10-21-11-9-16/h1-3,6-11,14H,4-5,12-13,15H2