2-(4-ethylphenyl)-N-(3-methoxypropyl)-6-phenylsulfanyl-pyrimidin-4-amine

Systemtic Name: 2-(4-ethylphenyl)-N-(3-methoxypropyl)-6-phenylsulfanyl-pyrimidin-4-amine Openeye Name: 2-(4-ethylphenyl)-N-(3-methoxypropyl)-6-phenylsulfanyl-pyrimidin-4-amine CAS Name: 2-(4-ethylphenyl)-N-(3-methoxypropyl)-6-(phenylthio)-4-pyrimidinamine IUPAC Name: 2-(4-ethylphenyl)-N-(3-methoxypropyl)-6-phenylsulfanylpyrimidin-4-amine Traditional Name: [2-(4-ethylphenyl)-6-(phenylthio)pyrimidin-4-yl]-(3-methoxypropyl)amine Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CC(=N2)SC3=CC=CC=C3)NCCCOC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CC(=N2)SC3=CC=CC=C3)NCCCOC

InChI

InChI=1S/C22H25N3OS/c1-3-17-10-12-18(13-11-17)22-24-20(23-14-7-15-26-2)16-21(25-22)27-19-8-5-4-6-9-19/h4-6,8-13,16H,3,7,14-15H2,1-2H3,(H,23,24,25)