2-(4-methoxyphenyl)-4-methylsulfanyl-6-pyrrolidin-1-yl-pyrimidine

Systemtic Name: 2-(4-methoxyphenyl)-4-methylsulfanyl-6-pyrrolidin-1-yl-pyrimidine Openeye Name: 2-(4-methoxyphenyl)-4-methylsulfanyl-6-pyrrolidin-1-yl-pyrimidine CAS Name: 2-(4-methoxyphenyl)-4-(methylthio)-6-(1-pyrrolidinyl)pyrimidine IUPAC Name: 2-(4-methoxyphenyl)-4-methylsulfanyl-6-pyrrolidin-1-ylpyrimidine Traditional Name: 2-(4-methoxyphenyl)-4-(methylthio)-6-pyrrolidino-pyrimidine Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=CC(=N2)SC)N3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=CC(=N2)SC)N3CCCC3

InChI

InChI=1S/C16H19N3OS/c1-20-13-7-5-12(6-8-13)16-17-14(11-15(18-16)21-2)19-9-3-4-10-19/h5-8,11H,3-4,9-10H2,1-2H3